NMR Restraints Grid

Result table
 (Save to zip file containing files for each block)

image mrblock_id pdb_id bmrb_id cing stage program type subtype subsubtype
420166 2eed 10163 cing 4-filtered-FRED Wattos check violation distance


data_2eed


save_distance_constraint_statistics_1
    _Distance_constraint_stats_list.Sf_category                   distance_constraint_statistics
    _Distance_constraint_stats_list.Constraint_list_ID            1
    _Distance_constraint_stats_list.Constraint_count              2057
    _Distance_constraint_stats_list.Viol_count                    359
    _Distance_constraint_stats_list.Viol_total                    61.811
    _Distance_constraint_stats_list.Viol_max                      0.095
    _Distance_constraint_stats_list.Viol_rms                      0.0016
    _Distance_constraint_stats_list.Viol_average_all_restraints   0.0001
    _Distance_constraint_stats_list.Viol_average_violations_only  0.0086
    _Distance_constraint_stats_list.Cutoff_violation_report       0.500
    _Distance_constraint_stats_list.Details                       
;
Description of the tags in this list:
*  1 * Administrative tag
*  2 * Administrative tag
*  3 * Administrative tag
*  4 * ID of the restraint list.                                                              
*  5 * Number of restraints in list.                                                          
*  6 * Number of violated restraints (each model violation is used).                          
*  7 * Sum of violations in Angstrom.                                                         
*  8 * Maximum violation of a restraint without averaging in any way.                         
*  9 * Rms of violations over all restraints.                                                 
*  10 * Average violation over all restraints.                                                 
*  11 * Average violation over violated restraints.                                            
           This violation is averaged over only those models in which the restraint is violated.   
           These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).     
*  12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
*  13 * This tag                                                                               

Description of the tags in the per residue table below:
*  1 * Chain identifier (can be absent if none defined)                   
*  2 * Residue number                                                     
*  3 * Residue name                                                       
*  4 * Maximum violation in ensemble of models (without any averaging)
*  5 * Model number with the maximum violation
*  6 * Number of models with a violation above cutoff
*  7 * List of models (1 character per model) with a violation above cutoff.
           An '*' marks a violation above the cutoff. A '+' indicates the largest
           violation above the cutoff and a '-' marks the smallest violation over cutoff.
           For models  5, 15, 25,... a ' ' is replaced by a '.'.
           For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
*  8 * Administrative tag
*  9 * Administrative tag

Description of the tags in the per restraint table below:
*  1 * Restraint ID within restraint list.                                
           First node, FIRST member, first atom's:                              
*  2 * Chain identifier (can be absent if none defined)                   
*  3 * Residue number                                                     
*  4 * Residue name                                                       
*  5 * Name of (pseudo-)atom                                              
           First node, SECOND member, first atom's:                             
*  6 * Chain identifier (can be absent if none defined)                   
*  7 * Residue number                                                     
*  8 * Residue name                                                       
*  9 * Name of (pseudo-)atom                                              
           FIRST node's:
*  10 * Target distance value (Angstrom)
*  11 * Lower bound distance (Angstrom)
*  12 * Upper bound distance (Angstrom)
*  13 * Average distance in ensemble of models
*  14 * Minimum distance in ensemble of models
*  15 * Maximum distance in ensemble of models
*  16 * Maximum violation (without any averaging)
*  17 * Model number with the maximum violation
*  18 * Number of models with a violation above cutoff
*  19 * List of models with a violation above cutoff. See description above.
*  20 * Administrative tag
*  21 * Administrative tag
;


    loop_
       _Distance_constraint_stats_per_res.Atom_entity_assembly_ID
       _Distance_constraint_stats_per_res.Atom_comp_index_ID
       _Distance_constraint_stats_per_res.Atom_comp_ID
       _Distance_constraint_stats_per_res.Total_violation
       _Distance_constraint_stats_per_res.Max_violation
       _Distance_constraint_stats_per_res.Max_violation_model_number
       _Distance_constraint_stats_per_res.Over_cutoff_viol_count
       _Distance_constraint_stats_per_res.Over_cutoff_viol_per_model

       1   8 SER 0.065 0.030 19 0 "[    .    1    .    2]" 
       1   9 SER 0.067 0.030 19 0 "[    .    1    .    2]" 
       1  10 ASP 0.000 0.000 19 0 "[    .    1    .    2]" 
       1  11 ALA 0.002 0.002  3 0 "[    .    1    .    2]" 
       1  12 SER 0.000 0.000  . 0 "[    .    1    .    2]" 
       1  13 LYS 0.085 0.020  1 0 "[    .    1    .    2]" 
       1  14 VAL 0.001 0.001 17 0 "[    .    1    .    2]" 
       1  15 THR 0.000 0.000 13 0 "[    .    1    .    2]" 
       1  16 SER 0.010 0.006 16 0 "[    .    1    .    2]" 
       1  17 LYS 0.018 0.006 12 0 "[    .    1    .    2]" 
       1  18 GLY 0.002 0.002 15 0 "[    .    1    .    2]" 
       1  19 ALA 0.017 0.010 15 0 "[    .    1    .    2]" 
       1  20 GLY 0.034 0.027 15 0 "[    .    1    .    2]" 
       1  21 LEU 0.166 0.083 15 0 "[    .    1    .    2]" 
       1  22 SER 0.094 0.083 15 0 "[    .    1    .    2]" 
       1  23 LYS 0.108 0.044 10 0 "[    .    1    .    2]" 
       1  24 ALA 0.053 0.029 20 0 "[    .    1    .    2]" 
       1  25 PHE 0.196 0.044 10 0 "[    .    1    .    2]" 
       1  26 VAL 0.015 0.014 20 0 "[    .    1    .    2]" 
       1  27 GLY 0.002 0.002  4 0 "[    .    1    .    2]" 
       1  28 GLN 0.079 0.042 20 0 "[    .    1    .    2]" 
       1  29 LYS 0.040 0.011 14 0 "[    .    1    .    2]" 
       1  30 SER 0.009 0.004 20 0 "[    .    1    .    2]" 
       1  31 SER 0.024 0.011 15 0 "[    .    1    .    2]" 
       1  32 PHE 0.011 0.005 20 0 "[    .    1    .    2]" 
       1  33 LEU 0.039 0.021 11 0 "[    .    1    .    2]" 
       1  34 VAL 0.039 0.021 11 0 "[    .    1    .    2]" 
       1  35 ASP 0.001 0.001 13 0 "[    .    1    .    2]" 
       1  36 CYS 0.002 0.002 18 0 "[    .    1    .    2]" 
       1  37 SER 0.000 0.000  . 0 "[    .    1    .    2]" 
       1  38 LYS 0.026 0.021 12 0 "[    .    1    .    2]" 
       1  39 ALA 0.005 0.002 15 0 "[    .    1    .    2]" 
       1  40 GLY 0.375 0.069  3 0 "[    .    1    .    2]" 
       1  41 SER 0.375 0.069  3 0 "[    .    1    .    2]" 
       1  42 ASN 0.068 0.057 19 0 "[    .    1    .    2]" 
       1  43 MET 0.035 0.011  8 0 "[    .    1    .    2]" 
       1  44 LEU 0.052 0.026  8 0 "[    .    1    .    2]" 
       1  45 LEU 0.125 0.026  8 0 "[    .    1    .    2]" 
       1  46 ILE 0.067 0.015  8 0 "[    .    1    .    2]" 
       1  47 GLY 0.076 0.018 19 0 "[    .    1    .    2]" 
       1  48 VAL 0.095 0.025 19 0 "[    .    1    .    2]" 
       1  49 HIS 0.093 0.025 19 0 "[    .    1    .    2]" 
       1  50 GLY 0.010 0.004  7 0 "[    .    1    .    2]" 
       1  51 PRO 0.056 0.018 12 0 "[    .    1    .    2]" 
       1  52 THR 0.013 0.007  7 0 "[    .    1    .    2]" 
       1  53 THR 0.315 0.065  5 0 "[    .    1    .    2]" 
       1  54 PRO 0.286 0.065  5 0 "[    .    1    .    2]" 
       1  55 CYS 0.103 0.024 18 0 "[    .    1    .    2]" 
       1  56 GLU 0.318 0.095 18 0 "[    .    1    .    2]" 
       1  57 GLU 0.332 0.051 19 0 "[    .    1    .    2]" 
       1  58 VAL 0.178 0.051 19 0 "[    .    1    .    2]" 
       1  59 SER 0.009 0.003 16 0 "[    .    1    .    2]" 
       1  60 MET 0.057 0.015 18 0 "[    .    1    .    2]" 
       1  61 LYS 0.207 0.062 15 0 "[    .    1    .    2]" 
       1  62 HIS 0.045 0.022 14 0 "[    .    1    .    2]" 
       1  63 VAL 0.001 0.001 11 0 "[    .    1    .    2]" 
       1  64 GLY 0.000 0.000 11 0 "[    .    1    .    2]" 
       1  65 ASN 0.001 0.001 13 0 "[    .    1    .    2]" 
       1  66 GLN 0.003 0.002 18 0 "[    .    1    .    2]" 
       1  67 GLN 0.005 0.002 18 0 "[    .    1    .    2]" 
       1  68 TYR 0.002 0.001 18 0 "[    .    1    .    2]" 
       1  69 ASN 0.007 0.002 18 0 "[    .    1    .    2]" 
       1  70 VAL 0.061 0.011 19 0 "[    .    1    .    2]" 
       1  71 THR 0.067 0.011 19 0 "[    .    1    .    2]" 
       1  72 TYR 0.178 0.024 14 0 "[    .    1    .    2]" 
       1  73 VAL 0.160 0.024 14 0 "[    .    1    .    2]" 
       1  74 VAL 0.007 0.006  4 0 "[    .    1    .    2]" 
       1  75 LYS 0.060 0.031 13 0 "[    .    1    .    2]" 
       1  76 GLU 0.005 0.004  3 0 "[    .    1    .    2]" 
       1  77 ARG 0.008 0.006  6 0 "[    .    1    .    2]" 
       1  78 GLY 0.000 0.000  . 0 "[    .    1    .    2]" 
       1  79 ASP 0.001 0.001  4 0 "[    .    1    .    2]" 
       1  80 TYR 0.002 0.002 11 0 "[    .    1    .    2]" 
       1  81 VAL 0.003 0.002 13 0 "[    .    1    .    2]" 
       1  82 LEU 0.001 0.001 19 0 "[    .    1    .    2]" 
       1  83 ALA 0.005 0.003 11 0 "[    .    1    .    2]" 
       1  84 VAL 0.001 0.001 14 0 "[    .    1    .    2]" 
       1  85 LYS 0.011 0.006  4 0 "[    .    1    .    2]" 
       1  86 TRP 0.013 0.007 19 0 "[    .    1    .    2]" 
       1  87 GLY 0.012 0.003 13 0 "[    .    1    .    2]" 
       1  88 GLU 0.011 0.005 19 0 "[    .    1    .    2]" 
       1  89 GLU 0.009 0.005 19 0 "[    .    1    .    2]" 
       1  90 HIS 0.044 0.028 13 0 "[    .    1    .    2]" 
       1  91 ILE 0.048 0.028 13 0 "[    .    1    .    2]" 
       1  92 PRO 0.010 0.002  8 0 "[    .    1    .    2]" 
       1  93 GLY 0.001 0.001 20 0 "[    .    1    .    2]" 
       1  94 SER 0.089 0.016 17 0 "[    .    1    .    2]" 
       1  95 PRO 0.000 0.000 17 0 "[    .    1    .    2]" 
       1  96 PHE 0.001 0.001 14 0 "[    .    1    .    2]" 
       1  97 HIS 0.001 0.001  3 0 "[    .    1    .    2]" 
       1  98 VAL 0.006 0.002 11 0 "[    .    1    .    2]" 
       1  99 THR 0.001 0.001  1 0 "[    .    1    .    2]" 
       1 100 VAL 0.001 0.001 18 0 "[    .    1    .    2]" 
       1 101 PRO 0.003 0.003  4 0 "[    .    1    .    2]" 
    stop_

    loop_
       _Distance_constraint_stats.Restraint_ID
       _Distance_constraint_stats.Atom_1_entity_assembly_ID
       _Distance_constraint_stats.Atom_1_comp_index_ID
       _Distance_constraint_stats.Atom_1_comp_ID
       _Distance_constraint_stats.Atom_1_ID
       _Distance_constraint_stats.Atom_2_entity_assembly_ID
       _Distance_constraint_stats.Atom_2_comp_index_ID
       _Distance_constraint_stats.Atom_2_comp_ID
       _Distance_constraint_stats.Atom_2_ID
       _Distance_constraint_stats.Node_1_distance_val
       _Distance_constraint_stats.Node_1_distance_lower_bound_val
       _Distance_constraint_stats.Node_1_distance_upper_bound_val
       _Distance_constraint_stats.Distance_average
       _Distance_constraint_stats.Distance_minimum
       _Distance_constraint_stats.Distance_maximum
       _Distance_constraint_stats.Max_violation
       _Distance_constraint_stats.Max_violation_model_number
       _Distance_constraint_stats.Over_cutoff_violation_count
       _Distance_constraint_stats.Over_cutoff_viol_per_model
       _Distance_constraint_stats.Distance_constraint_stats_ID

          1 1   8 SER HA   1   9 SER H    . . 3.310 2.375 2.137 3.328 0.018 16 0 "[    .    1    .    2]" 1 
          2 1   8 SER QB   1   9 SER H    . . 3.880 3.596 2.536 3.910 0.030 19 0 "[    .    1    .    2]" 1 
          3 1   9 SER H    1   9 SER HB2  . . 4.100 3.088 2.438 4.031     .  0 0 "[    .    1    .    2]" 1 
          4 1   9 SER H    1   9 SER QB   . . 3.520 2.703 2.331 3.322     .  0 0 "[    .    1    .    2]" 1 
          5 1   9 SER H    1   9 SER HB3  . . 4.100 3.406 2.362 3.896     .  0 0 "[    .    1    .    2]" 1 
          6 1   9 SER HA   1  10 ASP H    . . 3.100 2.158 2.137 2.233     .  0 0 "[    .    1    .    2]" 1 
          7 1   9 SER HA   1  40 GLY H    . . 5.170 4.657 4.176 5.083     .  0 0 "[    .    1    .    2]" 1 
          8 1   9 SER HA   1  40 GLY HA2  . . 4.930 3.778 3.000 4.666     .  0 0 "[    .    1    .    2]" 1 
          9 1   9 SER HA   1  40 GLY HA3  . . 4.100 2.422 2.052 2.993     .  0 0 "[    .    1    .    2]" 1 
         10 1   9 SER HA   1  41 SER H    . . 5.270 3.631 2.711 4.164     .  0 0 "[    .    1    .    2]" 1 
         11 1   9 SER HA   1  86 TRP HE1  . . 3.930 3.449 3.078 3.837     .  0 0 "[    .    1    .    2]" 1 
         12 1   9 SER QB   1  10 ASP H    . . 3.730 3.309 2.846 3.584     .  0 0 "[    .    1    .    2]" 1 
         13 1   9 SER QB   1  41 SER H    . . 4.050 3.428 2.257 3.956     .  0 0 "[    .    1    .    2]" 1 
         14 1   9 SER QB   1  42 ASN HB3  . . 3.880 3.436 2.989 3.828     .  0 0 "[    .    1    .    2]" 1 
         15 1   9 SER QB   1  42 ASN QD   . . 3.620 2.350 1.981 3.310     .  0 0 "[    .    1    .    2]" 1 
         16 1   9 SER QB   1  86 TRP HD1  . . 4.160 3.935 3.522 4.155     .  0 0 "[    .    1    .    2]" 1 
         17 1   9 SER QB   1  86 TRP HE1  . . 3.330 2.340 1.971 2.833     .  0 0 "[    .    1    .    2]" 1 
         18 1   9 SER HB2  1  10 ASP H    . . 4.570 3.951 3.236 4.407     .  0 0 "[    .    1    .    2]" 1 
         19 1   9 SER HB2  1  41 SER H    . . 4.740 4.320 3.313 4.726     .  0 0 "[    .    1    .    2]" 1 
         20 1   9 SER HB2  1  42 ASN HB2  . . 4.290 2.732 2.014 3.441     .  0 0 "[    .    1    .    2]" 1 
         21 1   9 SER HB2  1  42 ASN HB3  . . 4.540 3.967 3.103 4.538     .  0 0 "[    .    1    .    2]" 1 
         22 1   9 SER HB2  1  42 ASN HD21 . . 4.670 2.790 2.047 4.638     .  0 0 "[    .    1    .    2]" 1 
         23 1   9 SER HB2  1  42 ASN HD22 . . 4.670 3.588 2.173 4.661     .  0 0 "[    .    1    .    2]" 1 
         24 1   9 SER HB3  1  10 ASP H    . . 4.570 3.767 2.943 4.451     .  0 0 "[    .    1    .    2]" 1 
         25 1   9 SER HB3  1  41 SER H    . . 4.740 3.626 2.291 4.305     .  0 0 "[    .    1    .    2]" 1 
         26 1   9 SER HB3  1  42 ASN HB2  . . 4.290 2.551 2.053 3.234     .  0 0 "[    .    1    .    2]" 1 
         27 1   9 SER HB3  1  42 ASN HB3  . . 4.540 4.002 3.179 4.504     .  0 0 "[    .    1    .    2]" 1 
         28 1   9 SER HB3  1  42 ASN HD21 . . 4.670 3.124 2.272 4.223     .  0 0 "[    .    1    .    2]" 1 
         29 1   9 SER HB3  1  42 ASN HD22 . . 4.670 4.138 3.228 4.672 0.002  3 0 "[    .    1    .    2]" 1 
         30 1  10 ASP H    1  10 ASP HB2  . . 3.940 2.499 2.325 2.815     .  0 0 "[    .    1    .    2]" 1 
         31 1  10 ASP H    1  10 ASP HB3  . . 3.940 3.241 2.714 3.688     .  0 0 "[    .    1    .    2]" 1 
         32 1  10 ASP H    1  11 ALA H    . . 4.710 4.480 4.299 4.548     .  0 0 "[    .    1    .    2]" 1 
         33 1  10 ASP H    1  39 ALA HA   . . 4.450 3.469 2.871 3.994     .  0 0 "[    .    1    .    2]" 1 
         34 1  10 ASP H    1  39 ALA MB   . . 4.340 3.525 2.803 4.105     .  0 0 "[    .    1    .    2]" 1 
         35 1  10 ASP H    1  40 GLY HA3  . . 4.590 3.598 3.056 4.171     .  0 0 "[    .    1    .    2]" 1 
         36 1  10 ASP H    1  86 TRP HD1  . . 4.680 4.462 4.238 4.663     .  0 0 "[    .    1    .    2]" 1 
         37 1  10 ASP H    1  86 TRP HE1  . . 3.690 3.035 2.719 3.235     .  0 0 "[    .    1    .    2]" 1 
         38 1  10 ASP HA   1  11 ALA H    . . 2.930 2.214 2.140 2.277     .  0 0 "[    .    1    .    2]" 1 
         39 1  10 ASP HA   1  11 ALA MB   . . 4.080 3.954 3.902 4.000     .  0 0 "[    .    1    .    2]" 1 
         40 1  10 ASP HA   1  12 SER H    . . 4.260 4.065 3.812 4.257     .  0 0 "[    .    1    .    2]" 1 
         41 1  10 ASP QB   1  11 ALA H    . . 3.950 3.219 2.749 3.813     .  0 0 "[    .    1    .    2]" 1 
         42 1  10 ASP QB   1  11 ALA MB   . . 5.270 4.608 4.318 4.968     .  0 0 "[    .    1    .    2]" 1 
         43 1  10 ASP QB   1  12 SER H    . . 4.950 3.523 2.986 4.362     .  0 0 "[    .    1    .    2]" 1 
         44 1  10 ASP QB   1  13 LYS H    . . 4.570 2.894 2.667 3.310     .  0 0 "[    .    1    .    2]" 1 
         45 1  10 ASP QB   1  13 LYS QD   . . 5.180 3.938 3.552 4.323     .  0 0 "[    .    1    .    2]" 1 
         46 1  10 ASP QB   1  13 LYS QG   . . 3.700 2.164 1.918 2.358     .  0 0 "[    .    1    .    2]" 1 
         47 1  10 ASP QB   1  39 ALA HA   . . 4.190 3.390 2.963 3.846     .  0 0 "[    .    1    .    2]" 1 
         48 1  10 ASP HB2  1  11 ALA H    . . 4.660 4.227 4.043 4.473     .  0 0 "[    .    1    .    2]" 1 
         49 1  10 ASP HB2  1  13 LYS HG2  . . 5.120 3.223 2.614 3.983     .  0 0 "[    .    1    .    2]" 1 
         50 1  10 ASP HB2  1  13 LYS HG3  . . 5.120 3.336 2.585 4.416     .  0 0 "[    .    1    .    2]" 1 
         51 1  10 ASP HB2  1  39 ALA HA   . . 4.860 4.012 3.021 4.849     .  0 0 "[    .    1    .    2]" 1 
         52 1  10 ASP HB2  1  86 TRP HE1  . . 5.500 5.134 4.578 5.500 0.000 19 0 "[    .    1    .    2]" 1 
         53 1  10 ASP HB3  1  11 ALA H    . . 4.660 3.367 2.797 4.134     .  0 0 "[    .    1    .    2]" 1 
         54 1  10 ASP HB3  1  13 LYS HG2  . . 5.120 2.359 2.000 2.647     .  0 0 "[    .    1    .    2]" 1 
         55 1  10 ASP HB3  1  13 LYS HG3  . . 5.120 3.164 2.557 3.711     .  0 0 "[    .    1    .    2]" 1 
         56 1  10 ASP HB3  1  39 ALA HA   . . 4.860 4.039 3.125 4.860     .  0 0 "[    .    1    .    2]" 1 
         57 1  10 ASP HB3  1  86 TRP HE1  . . 5.500 5.232 4.845 5.498     .  0 0 "[    .    1    .    2]" 1 
         58 1  11 ALA H    1  11 ALA MB   . . 3.020 2.273 2.129 2.333     .  0 0 "[    .    1    .    2]" 1 
         59 1  11 ALA H    1  12 SER H    . . 3.390 2.327 2.183 2.596     .  0 0 "[    .    1    .    2]" 1 
         60 1  11 ALA H    1  13 LYS H    . . 4.880 3.892 3.740 4.196     .  0 0 "[    .    1    .    2]" 1 
         61 1  11 ALA H    1  86 TRP HD1  . . 3.990 3.233 2.770 3.476     .  0 0 "[    .    1    .    2]" 1 
         62 1  11 ALA H    1  89 GLU HB2  . . 5.060 4.504 4.118 4.701     .  0 0 "[    .    1    .    2]" 1 
         63 1  11 ALA H    1  89 GLU HB3  . . 5.120 4.191 3.899 4.462     .  0 0 "[    .    1    .    2]" 1 
         64 1  11 ALA HA   1  13 LYS H    . . 4.720 3.727 3.508 3.984     .  0 0 "[    .    1    .    2]" 1 
         65 1  11 ALA HA   1  14 VAL H    . . 3.990 3.057 2.934 3.173     .  0 0 "[    .    1    .    2]" 1 
         66 1  11 ALA HA   1  14 VAL HB   . . 4.660 2.953 2.766 3.314     .  0 0 "[    .    1    .    2]" 1 
         67 1  11 ALA HA   1  14 VAL MG2  . . 3.540 2.276 1.802 2.617     .  0 0 "[    .    1    .    2]" 1 
         68 1  11 ALA HA   1  39 ALA MB   . . 4.180 3.706 3.495 3.919     .  0 0 "[    .    1    .    2]" 1 
         69 1  11 ALA HA   1  86 TRP HB2  . . 4.290 3.860 3.479 4.138     .  0 0 "[    .    1    .    2]" 1 
         70 1  11 ALA HA   1  86 TRP QB   . . 3.690 2.928 2.546 3.075     .  0 0 "[    .    1    .    2]" 1 
         71 1  11 ALA HA   1  86 TRP HB3  . . 4.290 3.036 2.617 3.205     .  0 0 "[    .    1    .    2]" 1 
         72 1  11 ALA HA   1  86 TRP HD1  . . 3.500 2.069 2.000 2.266     .  0 0 "[    .    1    .    2]" 1 
         73 1  11 ALA HA   1  86 TRP HE1  . . 5.040 3.817 3.605 4.037     .  0 0 "[    .    1    .    2]" 1 
         74 1  11 ALA HA   1  89 GLU HB2  . . 4.830 4.617 4.350 4.801     .  0 0 "[    .    1    .    2]" 1 
         75 1  11 ALA HA   1  89 GLU HB3  . . 5.260 4.871 4.654 5.106     .  0 0 "[    .    1    .    2]" 1 
         76 1  11 ALA HA   1  91 ILE MG   . . 4.310 3.773 3.537 3.962     .  0 0 "[    .    1    .    2]" 1 
         77 1  11 ALA MB   1  12 SER H    . . 3.560 2.617 2.488 2.808     .  0 0 "[    .    1    .    2]" 1 
         78 1  11 ALA MB   1  12 SER HA   . . 4.190 3.782 3.692 3.864     .  0 0 "[    .    1    .    2]" 1 
         79 1  11 ALA MB   1  14 VAL H    . . 4.280 4.209 4.144 4.271     .  0 0 "[    .    1    .    2]" 1 
         80 1  11 ALA MB   1  14 VAL MG2  . . 3.910 3.520 2.951 3.811     .  0 0 "[    .    1    .    2]" 1 
         81 1  11 ALA MB   1  86 TRP H    . . 3.860 3.660 3.443 3.819     .  0 0 "[    .    1    .    2]" 1 
         82 1  11 ALA MB   1  86 TRP HB2  . . 3.840 3.453 2.948 3.811     .  0 0 "[    .    1    .    2]" 1 
         83 1  11 ALA MB   1  86 TRP QB   . . 3.170 2.197 1.914 2.453     .  0 0 "[    .    1    .    2]" 1 
         84 1  11 ALA MB   1  86 TRP HB3  . . 3.840 2.223 1.934 2.484     .  0 0 "[    .    1    .    2]" 1 
         85 1  11 ALA MB   1  86 TRP HD1  . . 3.600 2.408 2.170 2.581     .  0 0 "[    .    1    .    2]" 1 
         86 1  11 ALA MB   1  86 TRP HE1  . . 4.760 4.592 4.393 4.754     .  0 0 "[    .    1    .    2]" 1 
         87 1  11 ALA MB   1  89 GLU H    . . 5.030 4.756 4.641 4.928     .  0 0 "[    .    1    .    2]" 1 
         88 1  11 ALA MB   1  89 GLU HB2  . . 3.300 2.374 2.185 2.669     .  0 0 "[    .    1    .    2]" 1 
         89 1  11 ALA MB   1  89 GLU HB3  . . 3.270 2.247 2.098 2.388     .  0 0 "[    .    1    .    2]" 1 
         90 1  11 ALA MB   1  89 GLU HG2  . . 4.230 4.101 3.935 4.232 0.002  3 0 "[    .    1    .    2]" 1 
         91 1  11 ALA MB   1  89 GLU HG3  . . 4.030 3.893 3.745 4.013     .  0 0 "[    .    1    .    2]" 1 
         92 1  11 ALA MB   1  90 HIS H    . . 4.030 3.189 3.034 3.338     .  0 0 "[    .    1    .    2]" 1 
         93 1  11 ALA MB   1  91 ILE HA   . . 3.710 2.268 2.130 2.451     .  0 0 "[    .    1    .    2]" 1 
         94 1  11 ALA MB   1  91 ILE MG   . . 3.580 2.997 2.649 3.326     .  0 0 "[    .    1    .    2]" 1 
         95 1  11 ALA MB   1  92 PRO HD2  . . 4.190 3.892 3.764 4.044     .  0 0 "[    .    1    .    2]" 1 
         96 1  11 ALA MB   1  92 PRO HD3  . . 4.960 3.074 2.824 3.257     .  0 0 "[    .    1    .    2]" 1 
         97 1  12 SER H    1  12 SER QB   . . 3.090 2.325 2.157 2.541     .  0 0 "[    .    1    .    2]" 1 
         98 1  12 SER H    1  13 LYS H    . . 3.230 2.750 2.637 2.799     .  0 0 "[    .    1    .    2]" 1 
         99 1  12 SER H    1  14 VAL H    . . 4.700 4.231 3.979 4.471     .  0 0 "[    .    1    .    2]" 1 
        100 1  12 SER H    1  89 GLU HB3  . . 5.420 5.303 5.168 5.390     .  0 0 "[    .    1    .    2]" 1 
        101 1  12 SER HA   1  14 VAL H    . . 4.840 4.303 4.044 4.536     .  0 0 "[    .    1    .    2]" 1 
        102 1  12 SER HA   1  91 ILE HA   . . 4.490 4.232 4.113 4.359     .  0 0 "[    .    1    .    2]" 1 
        103 1  12 SER HA   1  92 PRO HD3  . . 4.340 2.073 2.003 2.212     .  0 0 "[    .    1    .    2]" 1 
        104 1  12 SER HA   1  92 PRO HG2  . . 3.940 3.670 3.614 3.778     .  0 0 "[    .    1    .    2]" 1 
        105 1  12 SER HA   1  92 PRO QG   . . 3.340 2.032 1.989 2.158     .  0 0 "[    .    1    .    2]" 1 
        106 1  12 SER HA   1  92 PRO HG3  . . 3.940 2.042 1.999 2.171     .  0 0 "[    .    1    .    2]" 1 
        107 1  12 SER QB   1  13 LYS H    . . 3.990 2.912 2.736 3.121     .  0 0 "[    .    1    .    2]" 1 
        108 1  12 SER QB   1  92 PRO QB   . . 5.040 3.844 3.549 4.319     .  0 0 "[    .    1    .    2]" 1 
        109 1  12 SER QB   1  92 PRO QG   . . 5.350 3.688 3.395 4.044     .  0 0 "[    .    1    .    2]" 1 
        110 1  13 LYS H    1  13 LYS HB2  . . 3.070 2.502 2.433 2.563     .  0 0 "[    .    1    .    2]" 1 
        111 1  13 LYS H    1  13 LYS HB3  . . 3.640 3.618 3.601 3.646 0.006  9 0 "[    .    1    .    2]" 1 
        112 1  13 LYS H    1  13 LYS QD   . . 3.510 3.468 3.374 3.511 0.001  4 0 "[    .    1    .    2]" 1 
        113 1  13 LYS H    1  13 LYS QE   . . 4.920 4.669 4.203 4.901     .  0 0 "[    .    1    .    2]" 1 
        114 1  13 LYS H    1  13 LYS HG2  . . 4.030 2.306 2.191 2.525     .  0 0 "[    .    1    .    2]" 1 
        115 1  13 LYS H    1  13 LYS QG   . . 3.320 2.284 2.173 2.495     .  0 0 "[    .    1    .    2]" 1 
        116 1  13 LYS H    1  13 LYS HG3  . . 4.030 3.704 3.593 3.901     .  0 0 "[    .    1    .    2]" 1 
        117 1  13 LYS H    1  14 VAL H    . . 3.050 2.391 2.264 2.476     .  0 0 "[    .    1    .    2]" 1 
        118 1  13 LYS H    1  14 VAL HB   . . 4.780 4.524 4.311 4.730     .  0 0 "[    .    1    .    2]" 1 
        119 1  13 LYS H    1  14 VAL MG2  . . 4.220 3.927 3.556 4.155     .  0 0 "[    .    1    .    2]" 1 
        120 1  13 LYS H    1  39 ALA HA   . . 4.370 4.267 4.060 4.372 0.002 15 0 "[    .    1    .    2]" 1 
        121 1  13 LYS H    1  39 ALA MB   . . 4.430 4.154 3.611 4.418     .  0 0 "[    .    1    .    2]" 1 
        122 1  13 LYS HA   1  13 LYS HD2  . . 3.760 2.426 1.999 3.030     .  0 0 "[    .    1    .    2]" 1 
        123 1  13 LYS HA   1  13 LYS QD   . . 3.160 2.048 1.988 2.183     .  0 0 "[    .    1    .    2]" 1 
        124 1  13 LYS HA   1  13 LYS HD3  . . 3.760 2.810 2.050 3.705     .  0 0 "[    .    1    .    2]" 1 
        125 1  13 LYS HA   1  13 LYS QE   . . 4.230 3.766 2.969 4.185     .  0 0 "[    .    1    .    2]" 1 
        126 1  13 LYS HA   1  13 LYS HG2  . . 3.960 3.107 3.063 3.160     .  0 0 "[    .    1    .    2]" 1 
        127 1  13 LYS HA   1  13 LYS QG   . . 3.340 2.969 2.935 2.998     .  0 0 "[    .    1    .    2]" 1 
        128 1  13 LYS HA   1  13 LYS HG3  . . 3.960 3.774 3.699 3.818     .  0 0 "[    .    1    .    2]" 1 
        129 1  13 LYS HB2  1  14 VAL H    . . 4.030 2.802 2.556 3.050     .  0 0 "[    .    1    .    2]" 1 
        130 1  13 LYS HB2  1  39 ALA H    . . 4.690 4.252 3.372 4.684     .  0 0 "[    .    1    .    2]" 1 
        131 1  13 LYS HB2  1  39 ALA HA   . . 3.710 2.041 1.998 2.234     .  0 0 "[    .    1    .    2]" 1 
        132 1  13 LYS HB2  1  39 ALA MB   . . 3.630 2.802 2.148 3.071     .  0 0 "[    .    1    .    2]" 1 
        133 1  13 LYS HB3  1  13 LYS QD   . . 3.610 2.522 2.306 2.876     .  0 0 "[    .    1    .    2]" 1 
        134 1  13 LYS HB3  1  13 LYS QE   . . 4.020 3.151 2.020 4.024 0.004  8 0 "[    .    1    .    2]" 1 
        135 1  13 LYS HB3  1  14 VAL H    . . 4.520 3.850 3.684 4.031     .  0 0 "[    .    1    .    2]" 1 
        136 1  13 LYS HB3  1  39 ALA H    . . 4.730 4.279 3.351 4.731 0.001  4 0 "[    .    1    .    2]" 1 
        137 1  13 LYS HB3  1  39 ALA HA   . . 4.220 2.968 2.439 3.430     .  0 0 "[    .    1    .    2]" 1 
        138 1  13 LYS HB3  1  39 ALA MB   . . 4.200 3.702 3.188 4.162     .  0 0 "[    .    1    .    2]" 1 
        139 1  13 LYS QE   1  13 LYS HG2  . . 3.370 2.919 2.394 3.390 0.020  1 0 "[    .    1    .    2]" 1 
        140 1  13 LYS QE   1  13 LYS QG   . . 2.840 2.208 2.103 2.293     .  0 0 "[    .    1    .    2]" 1 
        141 1  13 LYS QE   1  13 LYS HG3  . . 3.370 2.322 2.226 2.452     .  0 0 "[    .    1    .    2]" 1 
        142 1  13 LYS QG   1  14 VAL H    . . 4.910 4.045 3.906 4.156     .  0 0 "[    .    1    .    2]" 1 
        143 1  13 LYS QG   1  39 ALA HA   . . 4.120 3.036 2.506 3.237     .  0 0 "[    .    1    .    2]" 1 
        144 1  13 LYS HG2  1  39 ALA HA   . . 4.690 3.945 3.552 4.115     .  0 0 "[    .    1    .    2]" 1 
        145 1  13 LYS HG3  1  39 ALA HA   . . 4.690 3.160 2.562 3.386     .  0 0 "[    .    1    .    2]" 1 
        146 1  14 VAL H    1  14 VAL HB   . . 2.900 2.445 2.348 2.582     .  0 0 "[    .    1    .    2]" 1 
        147 1  14 VAL H    1  14 VAL MG1  . . 4.120 3.745 3.716 3.764     .  0 0 "[    .    1    .    2]" 1 
        148 1  14 VAL H    1  14 VAL MG2  . . 3.040 2.280 1.964 2.556     .  0 0 "[    .    1    .    2]" 1 
        149 1  14 VAL H    1  15 THR H    . . 4.730 4.545 4.445 4.617     .  0 0 "[    .    1    .    2]" 1 
        150 1  14 VAL H    1  15 THR MG   . . 5.500 4.686 4.497 4.870     .  0 0 "[    .    1    .    2]" 1 
        151 1  14 VAL H    1  39 ALA HA   . . 4.520 4.108 3.820 4.399     .  0 0 "[    .    1    .    2]" 1 
        152 1  14 VAL H    1  39 ALA MB   . . 3.620 3.033 2.657 3.378     .  0 0 "[    .    1    .    2]" 1 
        153 1  14 VAL H    1  91 ILE MG   . . 4.590 4.527 4.369 4.589     .  0 0 "[    .    1    .    2]" 1 
        154 1  14 VAL H    1  92 PRO HD3  . . 4.330 4.208 4.078 4.331 0.001 17 0 "[    .    1    .    2]" 1 
        155 1  14 VAL H    1  92 PRO QG   . . 5.250 4.311 4.162 4.462     .  0 0 "[    .    1    .    2]" 1 
        156 1  14 VAL HA   1  14 VAL MG1  . . 3.410 2.429 2.330 2.517     .  0 0 "[    .    1    .    2]" 1 
        157 1  14 VAL HA   1  14 VAL MG2  . . 3.540 2.255 2.117 2.427     .  0 0 "[    .    1    .    2]" 1 
        158 1  14 VAL HA   1  15 THR H    . . 2.720 2.159 2.140 2.232     .  0 0 "[    .    1    .    2]" 1 
        159 1  14 VAL HA   1  15 THR MG   . . 4.270 3.801 3.622 3.975     .  0 0 "[    .    1    .    2]" 1 
        160 1  14 VAL HA   1  35 ASP H    . . 5.490 5.229 4.911 5.444     .  0 0 "[    .    1    .    2]" 1 
        161 1  14 VAL HA   1  36 CYS HA   . . 4.060 3.026 2.766 3.404     .  0 0 "[    .    1    .    2]" 1 
        162 1  14 VAL HA   1  39 ALA MB   . . 4.230 2.842 2.377 3.339     .  0 0 "[    .    1    .    2]" 1 
        163 1  14 VAL HB   1  15 THR H    . . 4.480 4.244 3.995 4.386     .  0 0 "[    .    1    .    2]" 1 
        164 1  14 VAL HB   1  91 ILE HA   . . 4.740 3.574 3.338 3.726     .  0 0 "[    .    1    .    2]" 1 
        165 1  14 VAL HB   1  91 ILE MG   . . 3.670 2.388 2.158 2.503     .  0 0 "[    .    1    .    2]" 1 
        166 1  14 VAL HB   1  92 PRO HD2  . . 4.470 3.258 2.848 3.439     .  0 0 "[    .    1    .    2]" 1 
        167 1  14 VAL HB   1  92 PRO HD3  . . 4.530 3.880 3.685 4.069     .  0 0 "[    .    1    .    2]" 1 
        168 1  14 VAL MG1  1  15 THR H    . . 3.080 2.396 1.909 2.736     .  0 0 "[    .    1    .    2]" 1 
        169 1  14 VAL MG1  1  15 THR HA   . . 4.640 3.589 3.414 3.772     .  0 0 "[    .    1    .    2]" 1 
        170 1  14 VAL MG1  1  35 ASP H    . . 4.040 3.918 3.597 4.039     .  0 0 "[    .    1    .    2]" 1 
        171 1  14 VAL MG1  1  36 CYS HA   . . 4.000 3.642 3.321 3.961     .  0 0 "[    .    1    .    2]" 1 
        172 1  14 VAL MG1  1  36 CYS QB   . . 4.460 3.816 3.146 4.426     .  0 0 "[    .    1    .    2]" 1 
        173 1  14 VAL MG1  1  86 TRP QB   . . 4.680 3.252 3.053 3.558     .  0 0 "[    .    1    .    2]" 1 
        174 1  14 VAL MG1  1  91 ILE HB   . . 3.400 3.040 2.862 3.291     .  0 0 "[    .    1    .    2]" 1 
        175 1  14 VAL MG1  1  92 PRO HD3  . . 5.150 4.798 4.593 5.069     .  0 0 "[    .    1    .    2]" 1 
        176 1  14 VAL MG2  1  15 THR H    . . 4.060 3.860 3.674 4.007     .  0 0 "[    .    1    .    2]" 1 
        177 1  14 VAL MG2  1  36 CYS HA   . . 3.690 2.658 2.139 3.192     .  0 0 "[    .    1    .    2]" 1 
        178 1  14 VAL MG2  1  36 CYS QB   . . 4.240 2.891 2.338 3.386     .  0 0 "[    .    1    .    2]" 1 
        179 1  14 VAL MG2  1  39 ALA H    . . 4.470 4.161 3.502 4.463     .  0 0 "[    .    1    .    2]" 1 
        180 1  14 VAL MG2  1  39 ALA MB   . . 3.080 1.788 1.662 2.094     .  0 0 "[    .    1    .    2]" 1 
        181 1  14 VAL MG2  1  86 TRP HB2  . . 4.080 2.841 2.372 3.094     .  0 0 "[    .    1    .    2]" 1 
        182 1  14 VAL MG2  1  86 TRP QB   . . 3.580 2.704 2.250 2.942     .  0 0 "[    .    1    .    2]" 1 
        183 1  14 VAL MG2  1  86 TRP HB3  . . 4.080 3.401 2.794 3.684     .  0 0 "[    .    1    .    2]" 1 
        184 1  14 VAL MG2  1  86 TRP HD1  . . 4.260 2.987 2.630 3.241     .  0 0 "[    .    1    .    2]" 1 
        185 1  14 VAL MG2  1  86 TRP HE1  . . 4.110 3.166 2.945 3.378     .  0 0 "[    .    1    .    2]" 1 
        186 1  14 VAL MG2  1  91 ILE MG   . . 3.290 3.095 2.602 3.283     .  0 0 "[    .    1    .    2]" 1 
        187 1  15 THR H    1  15 THR HB   . . 3.840 3.757 3.697 3.815     .  0 0 "[    .    1    .    2]" 1 
        188 1  15 THR H    1  15 THR MG   . . 3.460 2.894 2.771 3.158     .  0 0 "[    .    1    .    2]" 1 
        189 1  15 THR H    1  16 SER H    . . 4.760 4.490 4.436 4.547     .  0 0 "[    .    1    .    2]" 1 
        190 1  15 THR H    1  34 VAL MG1  . . 4.060 3.416 3.032 3.820     .  0 0 "[    .    1    .    2]" 1 
        191 1  15 THR H    1  35 ASP H    . . 3.730 3.541 3.271 3.695     .  0 0 "[    .    1    .    2]" 1 
        192 1  15 THR H    1  35 ASP QB   . . 3.670 3.400 3.049 3.668     .  0 0 "[    .    1    .    2]" 1 
        193 1  15 THR H    1  36 CYS HA   . . 5.040 4.001 3.642 4.402     .  0 0 "[    .    1    .    2]" 1 
        194 1  15 THR HA   1  15 THR MG   . . 3.130 2.303 2.177 2.420     .  0 0 "[    .    1    .    2]" 1 
        195 1  15 THR HA   1  16 SER H    . . 2.770 2.293 2.231 2.469     .  0 0 "[    .    1    .    2]" 1 
        196 1  15 THR HA   1  16 SER HA   . . 4.790 4.444 4.419 4.539     .  0 0 "[    .    1    .    2]" 1 
        197 1  15 THR HB   1  16 SER H    . . 2.870 2.679 2.237 2.870 0.000 13 0 "[    .    1    .    2]" 1 
        198 1  15 THR MG   1  16 SER H    . . 3.920 3.730 3.554 3.868     .  0 0 "[    .    1    .    2]" 1 
        199 1  15 THR MG   1  35 ASP QB   . . 4.390 4.045 3.760 4.363     .  0 0 "[    .    1    .    2]" 1 
        200 1  16 SER H    1  16 SER HB2  . . 4.040 3.843 3.778 3.967     .  0 0 "[    .    1    .    2]" 1 
        201 1  16 SER H    1  16 SER HB3  . . 3.810 3.223 3.113 3.351     .  0 0 "[    .    1    .    2]" 1 
        202 1  16 SER H    1  16 SER HG   . . 3.300 2.350 1.984 3.189     .  0 0 "[    .    1    .    2]" 1 
        203 1  16 SER H    1  17 LYS H    . . 4.570 4.345 4.170 4.427     .  0 0 "[    .    1    .    2]" 1 
        204 1  16 SER H    1  21 LEU MD1  . . 4.930 4.320 4.043 4.548     .  0 0 "[    .    1    .    2]" 1 
        205 1  16 SER H    1  91 ILE MD   . . 5.010 4.580 4.293 4.854     .  0 0 "[    .    1    .    2]" 1 
        206 1  16 SER HA   1  17 LYS H    . . 2.790 2.192 2.157 2.229     .  0 0 "[    .    1    .    2]" 1 
        207 1  16 SER HA   1  17 LYS QD   . . 5.240 4.505 2.880 5.246 0.006 16 0 "[    .    1    .    2]" 1 
        208 1  16 SER HA   1  21 LEU MD1  . . 4.400 3.553 3.406 3.780     .  0 0 "[    .    1    .    2]" 1 
        209 1  16 SER HA   1  33 LEU QB   . . 5.500 4.862 4.576 5.168     .  0 0 "[    .    1    .    2]" 1 
        210 1  16 SER HA   1  34 VAL HA   . . 3.570 2.239 2.053 2.575     .  0 0 "[    .    1    .    2]" 1 
        211 1  16 SER HA   1  34 VAL MG1  . . 4.090 3.383 3.071 3.931     .  0 0 "[    .    1    .    2]" 1 
        212 1  16 SER HA   1  34 VAL MG2  . . 3.840 2.958 2.628 3.558     .  0 0 "[    .    1    .    2]" 1 
        213 1  16 SER HA   1  35 ASP H    . . 4.040 3.313 2.941 3.434     .  0 0 "[    .    1    .    2]" 1 
        214 1  16 SER HB2  1  17 LYS H    . . 3.240 3.068 2.912 3.243 0.003 12 0 "[    .    1    .    2]" 1 
        215 1  16 SER HB2  1  21 LEU MD1  . . 3.650 2.058 1.895 2.225     .  0 0 "[    .    1    .    2]" 1 
        216 1  16 SER HB2  1  21 LEU MD2  . . 4.150 2.468 2.141 3.032     .  0 0 "[    .    1    .    2]" 1 
        217 1  16 SER HB2  1  34 VAL HA   . . 4.110 3.894 3.428 4.108     .  0 0 "[    .    1    .    2]" 1 
        218 1  16 SER HB2  1  34 VAL MG2  . . 4.130 2.708 2.317 3.138     .  0 0 "[    .    1    .    2]" 1 
        219 1  16 SER HB2  1  91 ILE MD   . . 4.090 4.019 3.897 4.088     .  0 0 "[    .    1    .    2]" 1 
        220 1  16 SER HB3  1  17 LYS H    . . 4.240 4.104 3.956 4.233     .  0 0 "[    .    1    .    2]" 1 
        221 1  16 SER HB3  1  21 LEU MD1  . . 4.000 3.502 3.293 3.663     .  0 0 "[    .    1    .    2]" 1 
        222 1  16 SER HB3  1  21 LEU MD2  . . 4.530 3.525 3.162 4.039     .  0 0 "[    .    1    .    2]" 1 
        223 1  16 SER HB3  1  34 VAL HA   . . 3.620 3.514 3.125 3.615     .  0 0 "[    .    1    .    2]" 1 
        224 1  16 SER HB3  1  34 VAL MG1  . . 3.990 2.895 2.320 3.484     .  0 0 "[    .    1    .    2]" 1 
        225 1  16 SER HB3  1  34 VAL MG2  . . 3.940 2.480 2.034 2.896     .  0 0 "[    .    1    .    2]" 1 
        226 1  16 SER HB3  1  35 ASP H    . . 5.500 4.912 4.591 5.119     .  0 0 "[    .    1    .    2]" 1 
        227 1  16 SER HB3  1  91 ILE MD   . . 3.730 3.081 2.921 3.268     .  0 0 "[    .    1    .    2]" 1 
        228 1  16 SER HG   1  21 LEU MD1  . . 4.570 3.170 2.388 3.662     .  0 0 "[    .    1    .    2]" 1 
        229 1  16 SER HG   1  91 ILE MD   . . 3.960 3.217 2.361 3.915     .  0 0 "[    .    1    .    2]" 1 
        230 1  17 LYS H    1  17 LYS HB2  . . 4.110 3.814 3.699 3.895     .  0 0 "[    .    1    .    2]" 1 
        231 1  17 LYS H    1  17 LYS HB3  . . 4.110 3.221 2.997 3.502     .  0 0 "[    .    1    .    2]" 1 
        232 1  17 LYS H    1  17 LYS QD   . . 4.150 3.278 1.886 4.147     .  0 0 "[    .    1    .    2]" 1 
        233 1  17 LYS H    1  17 LYS QE   . . 4.720 4.108 3.170 4.726 0.006 12 0 "[    .    1    .    2]" 1 
        234 1  17 LYS H    1  17 LYS HG2  . . 4.220 2.706 1.989 3.725     .  0 0 "[    .    1    .    2]" 1 
        235 1  17 LYS H    1  17 LYS QG   . . 3.500 2.266 1.890 3.061     .  0 0 "[    .    1    .    2]" 1 
        236 1  17 LYS H    1  17 LYS HG3  . . 4.220 3.216 1.898 4.170     .  0 0 "[    .    1    .    2]" 1 
        237 1  17 LYS H    1  21 LEU MD1  . . 3.780 2.819 2.493 3.030     .  0 0 "[    .    1    .    2]" 1 
        238 1  17 LYS H    1  21 LEU MD2  . . 4.900 4.610 4.261 4.898     .  0 0 "[    .    1    .    2]" 1 
        239 1  17 LYS H    1  32 PHE HB2  . . 5.340 3.950 3.708 4.243     .  0 0 "[    .    1    .    2]" 1 
        240 1  17 LYS H    1  33 LEU H    . . 3.500 3.340 2.938 3.500 0.000  5 0 "[    .    1    .    2]" 1 
        241 1  17 LYS H    1  33 LEU QB   . . 4.340 3.754 3.390 4.027     .  0 0 "[    .    1    .    2]" 1 
        242 1  17 LYS H    1  33 LEU QD   . . 5.390 4.527 3.754 5.031     .  0 0 "[    .    1    .    2]" 1 
        243 1  17 LYS H    1  34 VAL HA   . . 4.360 3.569 3.236 4.092     .  0 0 "[    .    1    .    2]" 1 
        244 1  17 LYS H    1  35 ASP H    . . 4.990 4.670 4.423 4.987     .  0 0 "[    .    1    .    2]" 1 
        245 1  17 LYS HA   1  21 LEU MD1  . . 3.590 2.646 2.231 3.071     .  0 0 "[    .    1    .    2]" 1 
        246 1  17 LYS QB   1  17 LYS QE   . . 3.930 3.168 2.090 3.742     .  0 0 "[    .    1    .    2]" 1 
        247 1  17 LYS QB   1  18 GLY H    . . 3.980 2.552 2.200 2.791     .  0 0 "[    .    1    .    2]" 1 
        248 1  17 LYS HB2  1  17 LYS QD   . . 3.400 2.675 2.059 3.401 0.001 19 0 "[    .    1    .    2]" 1 
        249 1  17 LYS HB2  1  18 GLY H    . . 4.690 2.593 2.225 2.862     .  0 0 "[    .    1    .    2]" 1 
        250 1  17 LYS HB3  1  17 LYS QD   . . 3.400 2.530 2.089 3.390     .  0 0 "[    .    1    .    2]" 1 
        251 1  17 LYS HB3  1  18 GLY H    . . 4.690 3.828 3.455 4.062     .  0 0 "[    .    1    .    2]" 1 
        252 1  17 LYS QD   1  33 LEU QD   . . 3.970 3.411 2.542 3.959     .  0 0 "[    .    1    .    2]" 1 
        253 1  17 LYS QE   1  17 LYS HG2  . . 3.800 2.603 2.092 3.501     .  0 0 "[    .    1    .    2]" 1 
        254 1  17 LYS QE   1  17 LYS QG   . . 3.050 2.223 2.052 2.548     .  0 0 "[    .    1    .    2]" 1 
        255 1  17 LYS QE   1  17 LYS HG3  . . 3.800 2.720 2.075 3.305     .  0 0 "[    .    1    .    2]" 1 
        256 1  17 LYS QE   1  33 LEU QB   . . 4.570 2.722 1.929 3.913     .  0 0 "[    .    1    .    2]" 1 
        257 1  17 LYS QE   1  33 LEU QD   . . 3.430 2.890 2.028 3.430 0.000 16 0 "[    .    1    .    2]" 1 
        258 1  17 LYS QG   1  18 GLY H    . . 5.220 3.806 3.314 4.465     .  0 0 "[    .    1    .    2]" 1 
        259 1  17 LYS QG   1  18 GLY QA   . . 4.930 3.839 3.264 4.668     .  0 0 "[    .    1    .    2]" 1 
        260 1  17 LYS QG   1  33 LEU H    . . 4.620 3.115 2.539 4.281     .  0 0 "[    .    1    .    2]" 1 
        261 1  17 LYS QG   1  33 LEU QB   . . 3.610 2.686 2.077 3.462     .  0 0 "[    .    1    .    2]" 1 
        262 1  18 GLY H    1  21 LEU HB2  . . 5.500 4.563 3.745 5.502 0.002 15 0 "[    .    1    .    2]" 1 
        263 1  18 GLY H    1  21 LEU MD1  . . 4.640 3.074 2.485 3.782     .  0 0 "[    .    1    .    2]" 1 
        264 1  18 GLY QA   1  19 ALA MB   . . 4.820 3.737 3.620 3.794     .  0 0 "[    .    1    .    2]" 1 
        265 1  18 GLY QA   1  20 GLY H    . . 4.670 3.640 2.999 3.930     .  0 0 "[    .    1    .    2]" 1 
        266 1  18 GLY QA   1  32 PHE HB2  . . 4.840 3.310 2.983 3.786     .  0 0 "[    .    1    .    2]" 1 
        267 1  18 GLY QA   1  32 PHE HB3  . . 4.970 3.127 2.725 3.798     .  0 0 "[    .    1    .    2]" 1 
        268 1  18 GLY QA   1  33 LEU H    . . 4.300 3.509 3.157 3.870     .  0 0 "[    .    1    .    2]" 1 
        269 1  19 ALA HA   1  21 LEU H    . . 4.220 3.805 3.192 3.971     .  0 0 "[    .    1    .    2]" 1 
        270 1  19 ALA HA   1  22 SER H    . . 4.410 3.123 3.029 3.248     .  0 0 "[    .    1    .    2]" 1 
        271 1  19 ALA HA   1  23 LYS H    . . 4.680 3.612 3.336 4.210     .  0 0 "[    .    1    .    2]" 1 
        272 1  19 ALA HA   1  23 LYS QG   . . 5.170 4.212 3.797 4.507     .  0 0 "[    .    1    .    2]" 1 
        273 1  19 ALA MB   1  20 GLY H    . . 3.440 2.535 2.306 3.137     .  0 0 "[    .    1    .    2]" 1 
        274 1  19 ALA MB   1  20 GLY HA3  . . 4.520 4.252 4.139 4.527 0.007 15 0 "[    .    1    .    2]" 1 
        275 1  19 ALA MB   1  21 LEU H    . . 4.470 4.282 4.121 4.341     .  0 0 "[    .    1    .    2]" 1 
        276 1  19 ALA MB   1  22 SER H    . . 4.460 4.222 4.085 4.382     .  0 0 "[    .    1    .    2]" 1 
        277 1  19 ALA MB   1  22 SER HB2  . . 4.940 4.782 4.463 4.940 0.000 13 0 "[    .    1    .    2]" 1 
        278 1  19 ALA MB   1  22 SER HB3  . . 4.940 3.975 3.777 4.950 0.010 15 0 "[    .    1    .    2]" 1 
        279 1  19 ALA MB   1  31 SER H    . . 4.690 4.344 4.003 4.688     .  0 0 "[    .    1    .    2]" 1 
        280 1  20 GLY H    1  21 LEU H    . . 3.370 2.915 2.725 3.014     .  0 0 "[    .    1    .    2]" 1 
        281 1  20 GLY H    1  21 LEU MD1  . . 5.500 5.001 4.348 5.311     .  0 0 "[    .    1    .    2]" 1 
        282 1  20 GLY H    1  22 SER H    . . 4.970 4.372 4.211 4.468     .  0 0 "[    .    1    .    2]" 1 
        283 1  20 GLY H    1  32 PHE QD   . . 4.710 4.539 4.246 4.698     .  0 0 "[    .    1    .    2]" 1 
        284 1  20 GLY H    1  72 TYR HH   . . 5.180 4.542 4.295 5.145     .  0 0 "[    .    1    .    2]" 1 
        285 1  20 GLY HA2  1  22 SER H    . . 4.610 4.382 3.880 4.550     .  0 0 "[    .    1    .    2]" 1 
        286 1  20 GLY HA2  1  23 LYS H    . . 4.090 3.912 3.673 4.039     .  0 0 "[    .    1    .    2]" 1 
        287 1  20 GLY HA2  1  32 PHE QD   . . 5.010 4.786 3.886 4.988     .  0 0 "[    .    1    .    2]" 1 
        288 1  20 GLY HA2  1  72 TYR QE   . . 4.410 4.168 4.004 4.396     .  0 0 "[    .    1    .    2]" 1 
        289 1  20 GLY HA3  1  22 SER H    . . 4.970 4.771 4.660 4.858     .  0 0 "[    .    1    .    2]" 1 
        290 1  20 GLY HA3  1  23 LYS H    . . 5.200 5.153 4.968 5.227 0.027 15 0 "[    .    1    .    2]" 1 
        291 1  20 GLY HA3  1  30 SER HB3  . . 4.170 2.247 2.008 2.882     .  0 0 "[    .    1    .    2]" 1 
        292 1  20 GLY HA3  1  31 SER H    . . 4.160 4.014 3.555 4.158     .  0 0 "[    .    1    .    2]" 1 
        293 1  20 GLY HA3  1  32 PHE QD   . . 4.240 3.116 2.453 3.298     .  0 0 "[    .    1    .    2]" 1 
        294 1  20 GLY HA3  1  72 TYR QE   . . 4.260 3.687 3.341 4.027     .  0 0 "[    .    1    .    2]" 1 
        295 1  20 GLY HA3  1  72 TYR HH   . . 4.670 2.405 2.081 3.234     .  0 0 "[    .    1    .    2]" 1 
        296 1  21 LEU H    1  21 LEU HB2  . . 3.090 2.546 2.386 2.740     .  0 0 "[    .    1    .    2]" 1 
        297 1  21 LEU H    1  21 LEU HB3  . . 3.710 3.607 3.584 3.787 0.077 15 0 "[    .    1    .    2]" 1 
        298 1  21 LEU H    1  21 LEU MD1  . . 3.740 3.272 3.124 3.483     .  0 0 "[    .    1    .    2]" 1 
        299 1  21 LEU H    1  21 LEU MD2  . . 3.960 3.630 3.433 3.951     .  0 0 "[    .    1    .    2]" 1 
        300 1  21 LEU H    1  21 LEU HG   . . 3.090 2.239 1.964 2.664     .  0 0 "[    .    1    .    2]" 1 
        301 1  21 LEU H    1  22 SER H    . . 3.020 2.492 1.991 2.608     .  0 0 "[    .    1    .    2]" 1 
        302 1  21 LEU H    1  22 SER HB2  . . 5.170 4.835 4.642 5.253 0.083 15 0 "[    .    1    .    2]" 1 
        303 1  21 LEU H    1  22 SER QB   . . 4.470 4.357 4.243 4.445     .  0 0 "[    .    1    .    2]" 1 
        304 1  21 LEU H    1  22 SER HB3  . . 5.170 4.964 4.722 5.112     .  0 0 "[    .    1    .    2]" 1 
        305 1  21 LEU H    1  23 LYS H    . . 4.360 4.227 3.598 4.347     .  0 0 "[    .    1    .    2]" 1 
        306 1  21 LEU H    1  32 PHE HB2  . . 4.270 4.189 3.796 4.273 0.003 20 0 "[    .    1    .    2]" 1 
        307 1  21 LEU H    1  32 PHE HB3  . . 3.830 3.212 2.839 3.530     .  0 0 "[    .    1    .    2]" 1 
        308 1  21 LEU H    1  32 PHE QD   . . 4.540 4.375 4.134 4.539     .  0 0 "[    .    1    .    2]" 1 
        309 1  21 LEU H    1  72 TYR HH   . . 5.130 4.466 4.042 4.886     .  0 0 "[    .    1    .    2]" 1 
        310 1  21 LEU HA   1  21 LEU MD1  . . 4.070 3.950 3.902 3.987     .  0 0 "[    .    1    .    2]" 1 
        311 1  21 LEU HA   1  21 LEU MD2  . . 3.170 2.430 2.259 2.613     .  0 0 "[    .    1    .    2]" 1 
        312 1  21 LEU HA   1  21 LEU HG   . . 3.920 2.961 2.825 3.044     .  0 0 "[    .    1    .    2]" 1 
        313 1  21 LEU HA   1  82 LEU MD1  . . 4.850 4.746 4.592 4.843     .  0 0 "[    .    1    .    2]" 1 
        314 1  21 LEU HA   1  82 LEU MD2  . . 3.460 2.528 2.341 2.758     .  0 0 "[    .    1    .    2]" 1 
        315 1  21 LEU HA   1  98 VAL MG2  . . 3.910 2.948 2.689 3.222     .  0 0 "[    .    1    .    2]" 1 
        316 1  21 LEU HB2  1  21 LEU MD1  . . 3.280 2.152 2.012 2.245     .  0 0 "[    .    1    .    2]" 1 
        317 1  21 LEU HB2  1  21 LEU MD2  . . 3.670 3.145 3.120 3.164     .  0 0 "[    .    1    .    2]" 1 
        318 1  21 LEU HB2  1  22 SER H    . . 3.850 2.705 2.556 3.540     .  0 0 "[    .    1    .    2]" 1 
        319 1  21 LEU HB3  1  21 LEU MD1  . . 3.290 2.583 2.475 2.663     .  0 0 "[    .    1    .    2]" 1 
        320 1  21 LEU HB3  1  21 LEU MD2  . . 3.450 2.145 2.034 2.267     .  0 0 "[    .    1    .    2]" 1 
        321 1  21 LEU HB3  1  22 SER H    . . 4.370 3.807 3.687 4.371 0.001 15 0 "[    .    1    .    2]" 1 
        322 1  21 LEU HB3  1  82 LEU MD2  . . 4.250 3.459 3.171 3.698     .  0 0 "[    .    1    .    2]" 1 
        323 1  21 LEU HB3  1  96 PHE QD   . . 4.910 3.603 2.779 4.052     .  0 0 "[    .    1    .    2]" 1 
        324 1  21 LEU MD1  1  32 PHE HB2  . . 4.220 2.091 1.950 2.319     .  0 0 "[    .    1    .    2]" 1 
        325 1  21 LEU MD1  1  32 PHE HB3  . . 4.350 3.112 2.869 3.378     .  0 0 "[    .    1    .    2]" 1 
        326 1  21 LEU MD1  1  32 PHE QD   . . 4.320 3.230 2.812 3.604     .  0 0 "[    .    1    .    2]" 1 
        327 1  21 LEU MD1  1  33 LEU H    . . 4.820 3.800 3.501 4.031     .  0 0 "[    .    1    .    2]" 1 
        328 1  21 LEU MD1  1  96 PHE QD   . . 5.500 4.989 4.481 5.195     .  0 0 "[    .    1    .    2]" 1 
        329 1  21 LEU MD1  1  96 PHE QE   . . 4.720 4.411 3.650 4.691     .  0 0 "[    .    1    .    2]" 1 
        330 1  21 LEU MD1  1  96 PHE HZ   . . 5.500 4.798 4.183 5.308     .  0 0 "[    .    1    .    2]" 1 
        331 1  21 LEU MD2  1  32 PHE HB2  . . 4.320 2.872 2.216 3.371     .  0 0 "[    .    1    .    2]" 1 
        332 1  21 LEU MD2  1  32 PHE HB3  . . 4.270 3.338 2.835 3.829     .  0 0 "[    .    1    .    2]" 1 
        333 1  21 LEU MD2  1  32 PHE QD   . . 3.820 2.783 2.343 3.230     .  0 0 "[    .    1    .    2]" 1 
        334 1  21 LEU MD2  1  32 PHE QE   . . 4.340 3.481 2.980 3.807     .  0 0 "[    .    1    .    2]" 1 
        335 1  21 LEU MD2  1  82 LEU MD1  . . 4.100 3.593 3.368 3.738     .  0 0 "[    .    1    .    2]" 1 
        336 1  21 LEU MD2  1  82 LEU MD2  . . 3.280 1.843 1.673 2.035     .  0 0 "[    .    1    .    2]" 1 
        337 1  21 LEU MD2  1  84 VAL MG2  . . 4.030 3.215 2.928 3.473     .  0 0 "[    .    1    .    2]" 1 
        338 1  21 LEU MD2  1  96 PHE QD   . . 4.160 3.830 3.523 4.076     .  0 0 "[    .    1    .    2]" 1 
        339 1  21 LEU MD2  1  96 PHE QE   . . 4.500 3.949 3.581 4.280     .  0 0 "[    .    1    .    2]" 1 
        340 1  21 LEU MD2  1  96 PHE HZ   . . 5.120 4.526 3.861 4.951     .  0 0 "[    .    1    .    2]" 1 
        341 1  21 LEU HG   1  22 SER H    . . 4.560 4.270 4.081 4.504     .  0 0 "[    .    1    .    2]" 1 
        342 1  21 LEU HG   1  32 PHE HB2  . . 4.440 2.459 2.155 2.648     .  0 0 "[    .    1    .    2]" 1 
        343 1  21 LEU HG   1  32 PHE HB3  . . 4.310 2.307 2.004 2.563     .  0 0 "[    .    1    .    2]" 1 
        344 1  21 LEU HG   1  32 PHE QD   . . 4.780 3.498 3.187 3.681     .  0 0 "[    .    1    .    2]" 1 
        345 1  21 LEU HG   1  33 LEU H    . . 5.500 5.316 5.060 5.479     .  0 0 "[    .    1    .    2]" 1 
        346 1  21 LEU HG   1  82 LEU MD2  . . 3.890 3.668 3.450 3.859     .  0 0 "[    .    1    .    2]" 1 
        347 1  22 SER H    1  22 SER HB2  . . 4.100 2.561 2.416 3.541     .  0 0 "[    .    1    .    2]" 1 
        348 1  22 SER H    1  22 SER HB3  . . 4.100 2.703 2.577 3.385     .  0 0 "[    .    1    .    2]" 1 
        349 1  22 SER H    1  23 LYS H    . . 2.640 2.533 1.948 2.629     .  0 0 "[    .    1    .    2]" 1 
        350 1  22 SER H    1  23 LYS QB   . . 5.440 5.276 4.877 5.391     .  0 0 "[    .    1    .    2]" 1 
        351 1  22 SER H    1  98 VAL MG2  . . 4.290 4.139 3.851 4.280     .  0 0 "[    .    1    .    2]" 1 
        352 1  22 SER HA   1  98 VAL HA   . . 4.470 4.360 4.121 4.467     .  0 0 "[    .    1    .    2]" 1 
        353 1  22 SER HA   1  98 VAL MG2  . . 4.700 3.946 3.628 4.236     .  0 0 "[    .    1    .    2]" 1 
        354 1  22 SER QB   1  23 LYS QB   . . 5.260 3.816 3.630 3.978     .  0 0 "[    .    1    .    2]" 1 
        355 1  22 SER QB   1  23 LYS QG   . . 4.050 2.686 2.353 2.920     .  0 0 "[    .    1    .    2]" 1 
        356 1  22 SER QB   1  98 VAL MG2  . . 5.340 4.927 4.654 5.241     .  0 0 "[    .    1    .    2]" 1 
        357 1  22 SER HB2  1  23 LYS H    . . 4.380 3.580 3.507 3.683     .  0 0 "[    .    1    .    2]" 1 
        358 1  22 SER HB2  1  23 LYS QG   . . 4.670 4.260 2.858 4.604     .  0 0 "[    .    1    .    2]" 1 
        359 1  22 SER HB3  1  23 LYS H    . . 4.380 2.368 2.204 4.271     .  0 0 "[    .    1    .    2]" 1 
        360 1  22 SER HB3  1  23 LYS QG   . . 4.670 2.787 2.370 4.361     .  0 0 "[    .    1    .    2]" 1 
        361 1  23 LYS H    1  23 LYS QB   . . 3.420 3.233 3.120 3.362     .  0 0 "[    .    1    .    2]" 1 
        362 1  23 LYS H    1  23 LYS QG   . . 3.760 2.525 2.369 2.733     .  0 0 "[    .    1    .    2]" 1 
        363 1  23 LYS H    1  24 ALA H    . . 4.420 4.366 4.298 4.415     .  0 0 "[    .    1    .    2]" 1 
        364 1  23 LYS H    1  98 VAL MG1  . . 3.870 3.707 3.405 3.857     .  0 0 "[    .    1    .    2]" 1 
        365 1  23 LYS HA   1  23 LYS QD   . . 4.480 4.291 3.692 4.486 0.006 18 0 "[    .    1    .    2]" 1 
        366 1  23 LYS HA   1  23 LYS QG   . . 3.820 3.340 3.312 3.398     .  0 0 "[    .    1    .    2]" 1 
        367 1  23 LYS HA   1  24 ALA H    . . 2.630 2.388 2.233 2.642 0.012 10 0 "[    .    1    .    2]" 1 
        368 1  23 LYS HA   1  24 ALA HA   . . 4.700 4.463 4.387 4.620     .  0 0 "[    .    1    .    2]" 1 
        369 1  23 LYS HA   1  24 ALA MB   . . 4.270 3.809 3.738 3.934     .  0 0 "[    .    1    .    2]" 1 
        370 1  23 LYS HA   1  98 VAL MG1  . . 3.460 2.011 1.872 2.155     .  0 0 "[    .    1    .    2]" 1 
        371 1  23 LYS HA   1  99 THR H    . . 3.540 2.511 2.223 2.782     .  0 0 "[    .    1    .    2]" 1 
        372 1  23 LYS HA   1  99 THR HB   . . 4.540 4.342 3.996 4.540     .  0 0 "[    .    1    .    2]" 1 
        373 1  23 LYS QB   1  23 LYS QE   . . 4.290 2.908 2.004 3.708     .  0 0 "[    .    1    .    2]" 1 
        374 1  23 LYS QB   1  24 ALA H    . . 3.340 2.458 1.933 2.835     .  0 0 "[    .    1    .    2]" 1 
        375 1  23 LYS QB   1  24 ALA HA   . . 4.520 4.294 4.028 4.491     .  0 0 "[    .    1    .    2]" 1 
        376 1  23 LYS QB   1  25 PHE QD   . . 4.850 4.602 4.144 4.869 0.019 20 0 "[    .    1    .    2]" 1 
        377 1  23 LYS QB   1  25 PHE QE   . . 4.000 3.766 3.310 3.992     .  0 0 "[    .    1    .    2]" 1 
        378 1  23 LYS QB   1  98 VAL MG1  . . 4.320 3.458 3.230 3.671     .  0 0 "[    .    1    .    2]" 1 
        379 1  23 LYS QB   1  99 THR HB   . . 5.500 3.324 3.051 3.660     .  0 0 "[    .    1    .    2]" 1 
        380 1  23 LYS QD   1  25 PHE QE   . . 3.960 2.526 1.976 3.687     .  0 0 "[    .    1    .    2]" 1 
        381 1  23 LYS QD   1  25 PHE HZ   . . 3.800 2.816 2.380 3.707     .  0 0 "[    .    1    .    2]" 1 
        382 1  23 LYS HD2  1  25 PHE HZ   . . 4.450 3.142 2.418 4.449     .  0 0 "[    .    1    .    2]" 1 
        383 1  23 LYS HD3  1  25 PHE HZ   . . 4.450 3.758 2.567 4.450     .  0 0 "[    .    1    .    2]" 1 
        384 1  23 LYS QE   1  25 PHE HZ   . . 5.010 3.736 1.837 4.998     .  0 0 "[    .    1    .    2]" 1 
        385 1  23 LYS QG   1  24 ALA H    . . 4.040 3.692 3.324 3.984     .  0 0 "[    .    1    .    2]" 1 
        386 1  23 LYS QG   1  24 ALA HA   . . 5.420 3.949 3.560 4.708     .  0 0 "[    .    1    .    2]" 1 
        387 1  23 LYS QG   1  25 PHE QD   . . 5.080 4.076 3.241 5.124 0.044 10 0 "[    .    1    .    2]" 1 
        388 1  23 LYS QG   1  25 PHE QE   . . 4.330 2.770 2.007 3.748     .  0 0 "[    .    1    .    2]" 1 
        389 1  23 LYS QG   1  25 PHE HZ   . . 4.800 3.945 2.351 4.721     .  0 0 "[    .    1    .    2]" 1 
        390 1  24 ALA H    1  24 ALA MB   . . 3.090 2.521 2.347 2.794     .  0 0 "[    .    1    .    2]" 1 
        391 1  24 ALA H    1  25 PHE H    . . 4.710 4.432 4.239 4.516     .  0 0 "[    .    1    .    2]" 1 
        392 1  24 ALA H    1  98 VAL MG1  . . 3.380 2.365 1.974 2.951     .  0 0 "[    .    1    .    2]" 1 
        393 1  24 ALA H    1  99 THR H    . . 4.470 3.858 3.438 4.295     .  0 0 "[    .    1    .    2]" 1 
        394 1  24 ALA H    1 100 VAL HA   . . 4.930 3.194 2.937 3.353     .  0 0 "[    .    1    .    2]" 1 
        395 1  24 ALA H    1 100 VAL MG1  . . 4.700 4.260 4.023 4.479     .  0 0 "[    .    1    .    2]" 1 
        396 1  24 ALA H    1 100 VAL MG2  . . 3.580 2.611 2.105 3.236     .  0 0 "[    .    1    .    2]" 1 
        397 1  24 ALA H    1 101 PRO HD2  . . 4.640 4.348 3.809 4.628     .  0 0 "[    .    1    .    2]" 1 
        398 1  24 ALA H    1 101 PRO QD   . . 4.000 3.866 3.416 4.003 0.003  4 0 "[    .    1    .    2]" 1 
        399 1  24 ALA H    1 101 PRO HD3  . . 4.640 4.336 3.862 4.589     .  0 0 "[    .    1    .    2]" 1 
        400 1  24 ALA HA   1  25 PHE H    . . 2.790 2.403 2.221 2.579     .  0 0 "[    .    1    .    2]" 1 
        401 1  24 ALA HA   1  25 PHE HA   . . 5.000 4.446 4.379 4.506     .  0 0 "[    .    1    .    2]" 1 
        402 1  24 ALA HA   1  25 PHE QD   . . 4.170 3.092 2.518 4.101     .  0 0 "[    .    1    .    2]" 1 
        403 1  24 ALA HA   1  25 PHE QE   . . 4.720 4.307 3.892 4.749 0.029 20 0 "[    .    1    .    2]" 1 
        404 1  24 ALA HA   1  30 SER HB2  . . 4.520 4.317 4.098 4.524 0.004 20 0 "[    .    1    .    2]" 1 
        405 1  24 ALA HA   1  30 SER HB3  . . 4.460 4.298 3.988 4.437     .  0 0 "[    .    1    .    2]" 1 
        406 1  24 ALA HA   1  98 VAL MG1  . . 4.450 3.804 3.550 4.168     .  0 0 "[    .    1    .    2]" 1 
        407 1  24 ALA MB   1  25 PHE H    . . 3.170 2.486 2.195 2.862     .  0 0 "[    .    1    .    2]" 1 
        408 1  24 ALA MB   1  25 PHE QD   . . 5.450 4.170 3.796 4.763     .  0 0 "[    .    1    .    2]" 1 
        409 1  24 ALA MB   1  30 SER HB2  . . 3.680 3.006 2.692 3.418     .  0 0 "[    .    1    .    2]" 1 
        410 1  24 ALA MB   1  30 SER HB3  . . 3.730 3.430 3.129 3.671     .  0 0 "[    .    1    .    2]" 1 
        411 1  24 ALA MB   1  30 SER HG   . . 3.780 2.637 1.967 3.311     .  0 0 "[    .    1    .    2]" 1 
        412 1  24 ALA MB   1  72 TYR QD   . . 4.570 4.325 4.157 4.479     .  0 0 "[    .    1    .    2]" 1 
        413 1  24 ALA MB   1  72 TYR QE   . . 3.290 2.514 2.283 2.713     .  0 0 "[    .    1    .    2]" 1 
        414 1  24 ALA MB   1  72 TYR HH   . . 3.960 3.033 2.550 3.469     .  0 0 "[    .    1    .    2]" 1 
        415 1  24 ALA MB   1  74 VAL MG1  . . 3.610 3.282 2.891 3.609     .  0 0 "[    .    1    .    2]" 1 
        416 1  24 ALA MB   1  74 VAL MG2  . . 3.350 2.488 2.204 2.936     .  0 0 "[    .    1    .    2]" 1 
        417 1  24 ALA MB   1  98 VAL MG1  . . 2.980 2.047 1.813 2.359     .  0 0 "[    .    1    .    2]" 1 
        418 1  24 ALA MB   1 100 VAL MG2  . . 3.020 2.125 1.876 2.635     .  0 0 "[    .    1    .    2]" 1 
        419 1  25 PHE H    1  25 PHE HB2  . . 3.240 2.674 2.499 2.896     .  0 0 "[    .    1    .    2]" 1 
        420 1  25 PHE H    1  25 PHE HB3  . . 3.880 3.784 3.695 3.886 0.006 17 0 "[    .    1    .    2]" 1 
        421 1  25 PHE H    1  25 PHE QD   . . 3.690 2.842 2.379 3.465     .  0 0 "[    .    1    .    2]" 1 
        422 1  25 PHE H    1  25 PHE QE   . . 5.050 4.890 4.670 5.045     .  0 0 "[    .    1    .    2]" 1 
        423 1  25 PHE H    1  26 VAL H    . . 4.680 4.352 4.102 4.490     .  0 0 "[    .    1    .    2]" 1 
        424 1  25 PHE H    1  28 GLN HB2  . . 4.050 3.251 2.785 3.540     .  0 0 "[    .    1    .    2]" 1 
        425 1  25 PHE H    1  28 GLN HB3  . . 4.680 4.554 4.238 4.717 0.037 20 0 "[    .    1    .    2]" 1 
        426 1  25 PHE H    1  30 SER HB2  . . 4.670 4.553 4.326 4.662     .  0 0 "[    .    1    .    2]" 1 
        427 1  25 PHE H    1  30 SER HG   . . 4.530 2.934 2.491 3.566     .  0 0 "[    .    1    .    2]" 1 
        428 1  25 PHE H    1  74 VAL MG2  . . 4.300 3.721 3.178 4.063     .  0 0 "[    .    1    .    2]" 1 
        429 1  25 PHE H    1 100 VAL MG1  . . 5.060 3.957 3.708 4.342     .  0 0 "[    .    1    .    2]" 1 
        430 1  25 PHE H    1 100 VAL MG2  . . 4.790 3.914 3.542 4.779     .  0 0 "[    .    1    .    2]" 1 
        431 1  25 PHE HA   1  25 PHE QD   . . 3.750 2.925 2.099 3.148     .  0 0 "[    .    1    .    2]" 1 
        432 1  25 PHE HA   1  25 PHE QE   . . 4.770 4.636 4.449 4.694     .  0 0 "[    .    1    .    2]" 1 
        433 1  25 PHE HA   1  26 VAL H    . . 2.860 2.183 2.140 2.282     .  0 0 "[    .    1    .    2]" 1 
        434 1  25 PHE HA   1  26 VAL HA   . . 5.020 4.338 4.319 4.397     .  0 0 "[    .    1    .    2]" 1 
        435 1  25 PHE HA   1  26 VAL HB   . . 5.070 4.714 4.593 4.840     .  0 0 "[    .    1    .    2]" 1 
        436 1  25 PHE HA   1  26 VAL MG2  . . 3.950 3.701 3.546 3.828     .  0 0 "[    .    1    .    2]" 1 
        437 1  25 PHE HA   1  28 GLN HB2  . . 5.500 4.503 4.341 4.708     .  0 0 "[    .    1    .    2]" 1 
        438 1  25 PHE HA   1 100 VAL MG1  . . 3.480 2.142 1.969 2.472     .  0 0 "[    .    1    .    2]" 1 
        439 1  25 PHE HA   1 101 PRO HD2  . . 4.600 2.411 2.084 2.724     .  0 0 "[    .    1    .    2]" 1 
        440 1  25 PHE HA   1 101 PRO QD   . . 3.900 2.392 2.073 2.701     .  0 0 "[    .    1    .    2]" 1 
        441 1  25 PHE HA   1 101 PRO HD3  . . 4.600 4.005 3.529 4.451     .  0 0 "[    .    1    .    2]" 1 
        442 1  25 PHE HB2  1  26 VAL H    . . 4.220 4.127 3.915 4.234 0.014 20 0 "[    .    1    .    2]" 1 
        443 1  25 PHE HB2  1  28 GLN H    . . 4.180 3.748 3.450 3.962     .  0 0 "[    .    1    .    2]" 1 
        444 1  25 PHE HB2  1  28 GLN HB2  . . 4.060 2.054 1.973 2.164     .  0 0 "[    .    1    .    2]" 1 
        445 1  25 PHE HB3  1  26 VAL H    . . 3.680 3.148 2.743 3.597     .  0 0 "[    .    1    .    2]" 1 
        446 1  25 PHE HB3  1  28 GLN H    . . 4.660 3.976 3.753 4.427     .  0 0 "[    .    1    .    2]" 1 
        447 1  25 PHE HB3  1  28 GLN HB2  . . 4.120 3.311 3.008 3.769     .  0 0 "[    .    1    .    2]" 1 
        448 1  25 PHE HB3  1  28 GLN HB3  . . 5.270 4.610 4.190 5.054     .  0 0 "[    .    1    .    2]" 1 
        449 1  25 PHE HB3  1  28 GLN HE21 . . 5.240 3.549 1.901 5.168     .  0 0 "[    .    1    .    2]" 1 
        450 1  25 PHE HB3  1  28 GLN QE   . . 4.540 3.215 1.880 4.443     .  0 0 "[    .    1    .    2]" 1 
        451 1  25 PHE HB3  1  28 GLN HE22 . . 5.240 3.997 1.990 5.282 0.042 20 0 "[    .    1    .    2]" 1 
        452 1  25 PHE HB3  1  28 GLN QG   . . 3.830 2.871 2.023 3.633     .  0 0 "[    .    1    .    2]" 1 
        453 1  25 PHE HB3  1 101 PRO QG   . . 5.350 3.712 3.447 4.056     .  0 0 "[    .    1    .    2]" 1 
        454 1  25 PHE QD   1  26 VAL H    . . 4.520 4.221 4.070 4.426     .  0 0 "[    .    1    .    2]" 1 
        455 1  25 PHE QD   1  28 GLN QG   . . 4.800 3.968 3.247 4.571     .  0 0 "[    .    1    .    2]" 1 
        456 1  25 PHE QD   1 100 VAL MG1  . . 4.680 4.036 3.319 4.436     .  0 0 "[    .    1    .    2]" 1 
        457 1  25 PHE QD   1 101 PRO HD2  . . 4.550 3.300 2.101 3.891     .  0 0 "[    .    1    .    2]" 1 
        458 1  25 PHE QD   1 101 PRO QD   . . 3.870 3.116 2.060 3.641     .  0 0 "[    .    1    .    2]" 1 
        459 1  25 PHE QD   1 101 PRO HD3  . . 4.550 3.900 2.914 4.529     .  0 0 "[    .    1    .    2]" 1 
        460 1  25 PHE QD   1 101 PRO HG2  . . 3.880 2.700 2.119 3.167     .  0 0 "[    .    1    .    2]" 1 
        461 1  25 PHE QD   1 101 PRO HG3  . . 3.880 2.844 2.232 3.522     .  0 0 "[    .    1    .    2]" 1 
        462 1  25 PHE QE   1 101 PRO QD   . . 4.300 3.522 2.657 3.880     .  0 0 "[    .    1    .    2]" 1 
        463 1  25 PHE QE   1 101 PRO HG2  . . 4.010 3.672 3.191 4.001     .  0 0 "[    .    1    .    2]" 1 
        464 1  25 PHE QE   1 101 PRO HG3  . . 4.010 2.552 2.044 2.891     .  0 0 "[    .    1    .    2]" 1 
        465 1  26 VAL H    1  26 VAL HB   . . 3.130 2.598 2.502 2.711     .  0 0 "[    .    1    .    2]" 1 
        466 1  26 VAL H    1  26 VAL MG1  . . 4.140 3.766 3.758 3.783     .  0 0 "[    .    1    .    2]" 1 
        467 1  26 VAL H    1  26 VAL MG2  . . 2.960 2.120 1.877 2.288     .  0 0 "[    .    1    .    2]" 1 
        468 1  26 VAL H    1  27 GLY H    . . 4.940 4.576 4.496 4.620     .  0 0 "[    .    1    .    2]" 1 
        469 1  26 VAL H    1  74 VAL MG2  . . 4.580 3.792 3.439 3.997     .  0 0 "[    .    1    .    2]" 1 
        470 1  26 VAL H    1 100 VAL MG1  . . 3.310 2.314 2.038 2.702     .  0 0 "[    .    1    .    2]" 1 
        471 1  26 VAL H    1 101 PRO QD   . . 4.700 3.699 3.335 4.089     .  0 0 "[    .    1    .    2]" 1 
        472 1  26 VAL HA   1  26 VAL MG1  . . 3.280 2.391 2.242 2.473     .  0 0 "[    .    1    .    2]" 1 
        473 1  26 VAL HA   1  26 VAL MG2  . . 3.240 2.336 2.239 2.440     .  0 0 "[    .    1    .    2]" 1 
        474 1  26 VAL HA   1  27 GLY H    . . 2.770 2.177 2.145 2.214     .  0 0 "[    .    1    .    2]" 1 
        475 1  26 VAL HA   1  27 GLY HA2  . . 4.510 4.422 4.391 4.452     .  0 0 "[    .    1    .    2]" 1 
        476 1  26 VAL HA   1  27 GLY HA3  . . 4.590 4.434 4.398 4.466     .  0 0 "[    .    1    .    2]" 1 
        477 1  26 VAL HA   1  28 GLN H    . . 4.280 3.981 3.621 4.211     .  0 0 "[    .    1    .    2]" 1 
        478 1  26 VAL HA   1  74 VAL HB   . . 4.930 4.297 3.867 4.663     .  0 0 "[    .    1    .    2]" 1 
        479 1  26 VAL HA   1  74 VAL MG2  . . 3.350 2.338 2.029 2.545     .  0 0 "[    .    1    .    2]" 1 
        480 1  26 VAL HA   1  75 LYS HA   . . 4.390 4.030 3.479 4.387     .  0 0 "[    .    1    .    2]" 1 
        481 1  26 VAL HA   1 100 VAL MG1  . . 4.320 3.413 3.024 3.684     .  0 0 "[    .    1    .    2]" 1 
        482 1  26 VAL HB   1  27 GLY H    . . 4.260 4.113 3.991 4.244     .  0 0 "[    .    1    .    2]" 1 
        483 1  26 VAL MG1  1  27 GLY H    . . 3.290 2.335 1.965 2.685     .  0 0 "[    .    1    .    2]" 1 
        484 1  26 VAL MG1  1  27 GLY HA2  . . 4.040 3.477 3.317 3.617     .  0 0 "[    .    1    .    2]" 1 
        485 1  26 VAL MG1  1  27 GLY HA3  . . 3.630 3.283 3.099 3.561     .  0 0 "[    .    1    .    2]" 1 
        486 1  26 VAL MG1  1  75 LYS HA   . . 3.270 2.539 2.064 3.005     .  0 0 "[    .    1    .    2]" 1 
        487 1  26 VAL MG1  1  76 GLU H    . . 4.860 3.708 3.069 4.203     .  0 0 "[    .    1    .    2]" 1 
        488 1  26 VAL MG1  1  76 GLU HA   . . 3.880 3.339 2.633 3.815     .  0 0 "[    .    1    .    2]" 1 
        489 1  26 VAL MG2  1  74 VAL MG2  . . 3.230 2.961 2.728 3.230 0.000 18 0 "[    .    1    .    2]" 1 
        490 1  26 VAL MG2  1  76 GLU H    . . 4.460 3.689 3.097 4.421     .  0 0 "[    .    1    .    2]" 1 
        491 1  26 VAL MG2  1  76 GLU HA   . . 3.650 3.062 2.513 3.553     .  0 0 "[    .    1    .    2]" 1 
        492 1  26 VAL MG2  1  77 ARG H    . . 3.580 3.276 2.995 3.561     .  0 0 "[    .    1    .    2]" 1 
        493 1  26 VAL MG2  1  77 ARG HA   . . 3.880 2.877 2.653 3.304     .  0 0 "[    .    1    .    2]" 1 
        494 1  26 VAL MG2  1  77 ARG HB2  . . 4.230 3.407 3.075 4.230     .  6 0 "[    .    1    .    2]" 1 
        495 1  26 VAL MG2  1  77 ARG QB   . . 3.710 2.141 1.872 3.507     .  0 0 "[    .    1    .    2]" 1 
        496 1  26 VAL MG2  1  77 ARG HB3  . . 4.230 2.178 1.888 3.744     .  0 0 "[    .    1    .    2]" 1 
        497 1  26 VAL MG2  1  77 ARG HD2  . . 4.650 3.411 2.094 4.575     .  0 0 "[    .    1    .    2]" 1 
        498 1  26 VAL MG2  1  77 ARG HD3  . . 4.650 3.122 2.408 3.899     .  0 0 "[    .    1    .    2]" 1 
        499 1  26 VAL MG2  1  77 ARG HG2  . . 4.440 3.571 1.921 4.221     .  0 0 "[    .    1    .    2]" 1 
        500 1  26 VAL MG2  1  77 ARG QG   . . 3.720 3.292 1.809 3.662     .  0 0 "[    .    1    .    2]" 1 
        501 1  26 VAL MG2  1  77 ARG HG3  . . 4.440 4.043 1.842 4.437     .  0 0 "[    .    1    .    2]" 1 
        502 1  26 VAL MG2  1 100 VAL HB   . . 4.400 3.838 3.610 4.043     .  0 0 "[    .    1    .    2]" 1 
        503 1  27 GLY H    1  28 GLN H    . . 3.470 3.350 2.769 3.463     .  0 0 "[    .    1    .    2]" 1 
        504 1  27 GLY H    1  28 GLN QG   . . 5.500 5.229 4.962 5.492     .  0 0 "[    .    1    .    2]" 1 
        505 1  27 GLY H    1  73 VAL MG1  . . 3.680 3.434 3.116 3.651     .  0 0 "[    .    1    .    2]" 1 
        506 1  27 GLY H    1  74 VAL HB   . . 5.500 5.147 4.652 5.489     .  0 0 "[    .    1    .    2]" 1 
        507 1  27 GLY H    1  74 VAL MG2  . . 3.680 3.074 2.545 3.369     .  0 0 "[    .    1    .    2]" 1 
        508 1  27 GLY H    1  75 LYS HA   . . 3.930 3.284 2.858 3.830     .  0 0 "[    .    1    .    2]" 1 
        509 1  27 GLY H    1  75 LYS QD   . . 4.700 3.998 3.585 4.554     .  0 0 "[    .    1    .    2]" 1 
        510 1  27 GLY HA2  1  73 VAL MG1  . . 3.600 3.204 2.848 3.600     .  0 0 "[    .    1    .    2]" 1 
        511 1  27 GLY HA2  1  75 LYS QD   . . 4.630 3.811 3.029 4.177     .  0 0 "[    .    1    .    2]" 1 
        512 1  27 GLY HA3  1  28 GLN HA   . . 5.130 4.320 4.305 4.380     .  0 0 "[    .    1    .    2]" 1 
        513 1  27 GLY HA3  1  75 LYS QD   . . 5.500 5.035 4.246 5.502 0.002  4 0 "[    .    1    .    2]" 1 
        514 1  28 GLN H    1  28 GLN HB2  . . 3.040 2.510 2.366 2.668     .  0 0 "[    .    1    .    2]" 1 
        515 1  28 GLN H    1  28 GLN HB3  . . 3.670 3.588 3.570 3.633     .  0 0 "[    .    1    .    2]" 1 
        516 1  28 GLN H    1  28 GLN QG   . . 3.420 2.243 1.975 3.087     .  0 0 "[    .    1    .    2]" 1 
        517 1  28 GLN H    1  29 LYS H    . . 5.060 4.578 4.388 4.638     .  0 0 "[    .    1    .    2]" 1 
        518 1  28 GLN H    1  73 VAL MG1  . . 5.230 4.833 4.414 5.127     .  0 0 "[    .    1    .    2]" 1 
        519 1  28 GLN H    1  74 VAL MG2  . . 5.150 4.631 3.996 4.919     .  0 0 "[    .    1    .    2]" 1 
        520 1  28 GLN HA   1  28 GLN QG   . . 3.640 2.421 2.275 2.732     .  0 0 "[    .    1    .    2]" 1 
        521 1  28 GLN HA   1  29 LYS H    . . 3.240 2.319 2.145 2.616     .  0 0 "[    .    1    .    2]" 1 
        522 1  28 GLN HB2  1  28 GLN QE   . . 4.500 3.634 3.043 4.110     .  0 0 "[    .    1    .    2]" 1 
        523 1  28 GLN HB2  1  29 LYS H    . . 4.480 3.842 3.285 4.427     .  0 0 "[    .    1    .    2]" 1 
        524 1  28 GLN HB3  1  29 LYS H    . . 3.860 2.771 1.981 3.679     .  0 0 "[    .    1    .    2]" 1 
        525 1  28 GLN QG   1  29 LYS H    . . 4.570 4.019 3.632 4.354     .  0 0 "[    .    1    .    2]" 1 
        526 1  29 LYS H    1  29 LYS HB2  . . 3.790 2.517 2.200 2.965     .  0 0 "[    .    1    .    2]" 1 
        527 1  29 LYS H    1  29 LYS QB   . . 3.260 2.338 2.137 2.551     .  0 0 "[    .    1    .    2]" 1 
        528 1  29 LYS H    1  29 LYS HB3  . . 3.790 2.823 2.714 2.938     .  0 0 "[    .    1    .    2]" 1 
        529 1  29 LYS H    1  29 LYS QD   . . 4.900 4.598 4.337 4.890     .  0 0 "[    .    1    .    2]" 1 
        530 1  29 LYS H    1  29 LYS HG2  . . 4.820 4.588 4.497 4.685     .  0 0 "[    .    1    .    2]" 1 
        531 1  29 LYS H    1  29 LYS QG   . . 4.120 3.998 3.829 4.124 0.004  3 0 "[    .    1    .    2]" 1 
        532 1  29 LYS H    1  29 LYS HG3  . . 4.820 4.405 4.128 4.687     .  0 0 "[    .    1    .    2]" 1 
        533 1  29 LYS H    1  73 VAL MG2  . . 4.800 4.621 4.124 4.800 0.000 14 0 "[    .    1    .    2]" 1 
        534 1  29 LYS HA   1  29 LYS QD   . . 4.100 4.018 3.825 4.111 0.011 14 0 "[    .    1    .    2]" 1 
        535 1  29 LYS HA   1  29 LYS QE   . . 4.870 4.252 3.680 4.772     .  0 0 "[    .    1    .    2]" 1 
        536 1  29 LYS HA   1  29 LYS HG2  . . 3.900 2.850 2.515 3.220     .  0 0 "[    .    1    .    2]" 1 
        537 1  29 LYS HA   1  29 LYS HG3  . . 3.900 2.445 2.300 2.695     .  0 0 "[    .    1    .    2]" 1 
        538 1  29 LYS HA   1  30 SER H    . . 2.710 2.160 2.141 2.192     .  0 0 "[    .    1    .    2]" 1 
        539 1  29 LYS HA   1  30 SER HB2  . . 5.210 4.370 4.290 4.520     .  0 0 "[    .    1    .    2]" 1 
        540 1  29 LYS HA   1  71 THR MG   . . 3.950 3.702 3.527 3.903     .  0 0 "[    .    1    .    2]" 1 
        541 1  29 LYS HA   1  72 TYR H    . . 5.020 4.810 4.432 5.006     .  0 0 "[    .    1    .    2]" 1 
        542 1  29 LYS HA   1  73 VAL HA   . . 4.330 3.343 3.109 3.524     .  0 0 "[    .    1    .    2]" 1 
        543 1  29 LYS HA   1  73 VAL MG2  . . 3.180 2.517 2.114 2.867     .  0 0 "[    .    1    .    2]" 1 
        544 1  29 LYS QB   1  29 LYS QD   . . 3.210 2.128 2.022 2.255     .  0 0 "[    .    1    .    2]" 1 
        545 1  29 LYS QB   1  29 LYS QE   . . 4.200 2.959 2.219 3.673     .  0 0 "[    .    1    .    2]" 1 
        546 1  29 LYS QB   1  30 SER H    . . 4.020 3.873 3.757 3.928     .  0 0 "[    .    1    .    2]" 1 
        547 1  29 LYS QB   1  71 THR MG   . . 3.520 3.251 2.884 3.504     .  0 0 "[    .    1    .    2]" 1 
        548 1  29 LYS QB   1  73 VAL MG2  . . 4.000 3.296 2.927 3.521     .  0 0 "[    .    1    .    2]" 1 
        549 1  29 LYS HB2  1  29 LYS QE   . . 4.810 3.139 2.244 4.095     .  0 0 "[    .    1    .    2]" 1 
        550 1  29 LYS HB2  1  30 SER H    . . 4.640 4.537 4.403 4.612     .  0 0 "[    .    1    .    2]" 1 
        551 1  29 LYS HB2  1  71 THR MG   . . 4.300 4.211 3.971 4.302 0.002  5 0 "[    .    1    .    2]" 1 
        552 1  29 LYS HB2  1  73 VAL MG2  . . 4.550 3.422 3.018 3.692     .  0 0 "[    .    1    .    2]" 1 
        553 1  29 LYS HB3  1  29 LYS QE   . . 4.810 3.777 3.106 4.203     .  0 0 "[    .    1    .    2]" 1 
        554 1  29 LYS HB3  1  30 SER H    . . 4.640 4.202 4.075 4.257     .  0 0 "[    .    1    .    2]" 1 
        555 1  29 LYS HB3  1  71 THR MG   . . 4.300 3.387 2.962 3.712     .  0 0 "[    .    1    .    2]" 1 
        556 1  29 LYS HB3  1  73 VAL MG2  . . 4.550 4.318 3.944 4.526     .  0 0 "[    .    1    .    2]" 1 
        557 1  29 LYS QD   1  71 THR HB   . . 4.190 3.643 2.722 4.192 0.002  5 0 "[    .    1    .    2]" 1 
        558 1  29 LYS QD   1  71 THR MG   . . 3.070 2.468 1.911 2.908     .  0 0 "[    .    1    .    2]" 1 
        559 1  29 LYS QD   1  73 VAL MG2  . . 3.760 3.611 2.881 3.759     .  0 0 "[    .    1    .    2]" 1 
        560 1  29 LYS QE   1  29 LYS HG2  . . 3.820 3.038 2.395 3.396     .  0 0 "[    .    1    .    2]" 1 
        561 1  29 LYS QE   1  29 LYS QG   . . 3.300 2.172 2.022 2.347     .  0 0 "[    .    1    .    2]" 1 
        562 1  29 LYS QE   1  29 LYS HG3  . . 3.820 2.259 2.082 2.675     .  0 0 "[    .    1    .    2]" 1 
        563 1  29 LYS QE   1  57 GLU QG   . . 5.480 4.913 4.009 5.478     .  0 0 "[    .    1    .    2]" 1 
        564 1  29 LYS QE   1  71 THR MG   . . 3.910 3.407 2.248 3.911 0.001 11 0 "[    .    1    .    2]" 1 
        565 1  29 LYS QE   1  73 VAL MG2  . . 3.550 2.757 1.989 3.459     .  0 0 "[    .    1    .    2]" 1 
        566 1  29 LYS QG   1  71 THR HB   . . 4.160 3.523 3.307 3.807     .  0 0 "[    .    1    .    2]" 1 
        567 1  29 LYS QG   1  71 THR MG   . . 3.630 1.804 1.764 1.887     .  0 0 "[    .    1    .    2]" 1 
        568 1  29 LYS QG   1  73 VAL MG2  . . 3.110 2.054 1.826 2.183     .  0 0 "[    .    1    .    2]" 1 
        569 1  29 LYS HG2  1  30 SER H    . . 4.390 3.563 3.150 3.867     .  0 0 "[    .    1    .    2]" 1 
        570 1  29 LYS HG2  1  71 THR HB   . . 4.750 3.675 3.397 4.047     .  0 0 "[    .    1    .    2]" 1 
        571 1  29 LYS HG2  1  71 THR MG   . . 4.230 1.822 1.777 1.899     .  0 0 "[    .    1    .    2]" 1 
        572 1  29 LYS HG2  1  73 VAL MG2  . . 3.570 3.288 2.756 3.571 0.001  7 0 "[    .    1    .    2]" 1 
        573 1  29 LYS HG3  1  30 SER H    . . 4.390 3.911 3.186 4.389     .  0 0 "[    .    1    .    2]" 1 
        574 1  29 LYS HG3  1  71 THR HB   . . 4.750 4.560 4.302 4.736     .  0 0 "[    .    1    .    2]" 1 
        575 1  29 LYS HG3  1  71 THR MG   . . 4.230 2.969 2.453 3.272     .  0 0 "[    .    1    .    2]" 1 
        576 1  29 LYS HG3  1  73 VAL MG2  . . 3.570 2.077 1.849 2.202     .  0 0 "[    .    1    .    2]" 1 
        577 1  30 SER H    1  30 SER HB2  . . 3.320 2.269 2.195 2.382     .  0 0 "[    .    1    .    2]" 1 
        578 1  30 SER H    1  30 SER HB3  . . 3.650 3.537 3.493 3.599     .  0 0 "[    .    1    .    2]" 1 
        579 1  30 SER H    1  30 SER HG   . . 3.940 3.289 2.713 3.902     .  0 0 "[    .    1    .    2]" 1 
        580 1  30 SER H    1  71 THR HA   . . 5.300 5.235 5.084 5.302 0.002 18 0 "[    .    1    .    2]" 1 
        581 1  30 SER H    1  71 THR MG   . . 3.870 3.397 3.238 3.565     .  0 0 "[    .    1    .    2]" 1 
        582 1  30 SER H    1  72 TYR H    . . 3.840 3.704 3.441 3.841 0.001 12 0 "[    .    1    .    2]" 1 
        583 1  30 SER H    1  73 VAL HA   . . 4.210 3.594 3.360 3.783     .  0 0 "[    .    1    .    2]" 1 
        584 1  30 SER H    1  73 VAL MG2  . . 3.790 3.690 3.558 3.792 0.002 18 0 "[    .    1    .    2]" 1 
        585 1  30 SER HA   1  31 SER H    . . 2.820 2.155 2.139 2.187     .  0 0 "[    .    1    .    2]" 1 
        586 1  30 SER HA   1  31 SER HA   . . 4.470 4.399 4.392 4.408     .  0 0 "[    .    1    .    2]" 1 
        587 1  30 SER HB2  1  31 SER H    . . 4.470 4.358 4.265 4.444     .  0 0 "[    .    1    .    2]" 1 
        588 1  30 SER HB2  1  72 TYR H    . . 4.390 3.996 3.560 4.362     .  0 0 "[    .    1    .    2]" 1 
        589 1  30 SER HB2  1  72 TYR QD   . . 4.440 3.624 3.225 4.038     .  0 0 "[    .    1    .    2]" 1 
        590 1  30 SER HB2  1  72 TYR QE   . . 4.080 2.749 2.422 3.213     .  0 0 "[    .    1    .    2]" 1 
        591 1  30 SER HB2  1  74 VAL MG2  . . 4.960 4.519 4.261 4.830     .  0 0 "[    .    1    .    2]" 1 
        592 1  30 SER HB3  1  31 SER H    . . 3.690 3.333 3.173 3.495     .  0 0 "[    .    1    .    2]" 1 
        593 1  30 SER HB3  1  32 PHE QD   . . 4.740 4.172 3.996 4.518     .  0 0 "[    .    1    .    2]" 1 
        594 1  30 SER HB3  1  72 TYR H    . . 4.910 4.568 4.279 4.871     .  0 0 "[    .    1    .    2]" 1 
        595 1  30 SER HB3  1  72 TYR QD   . . 5.300 4.648 4.256 4.934     .  0 0 "[    .    1    .    2]" 1 
        596 1  30 SER HB3  1  72 TYR QE   . . 4.130 3.533 3.178 3.873     .  0 0 "[    .    1    .    2]" 1 
        597 1  30 SER HB3  1  72 TYR HH   . . 4.320 2.710 2.214 3.151     .  0 0 "[    .    1    .    2]" 1 
        598 1  30 SER HB3  1  98 VAL MG1  . . 5.500 5.161 4.774 5.481     .  0 0 "[    .    1    .    2]" 1 
        599 1  31 SER H    1  31 SER HB2  . . 3.860 3.832 3.800 3.871 0.011 15 0 "[    .    1    .    2]" 1 
        600 1  31 SER H    1  31 SER HB3  . . 3.370 2.838 2.758 3.040     .  0 0 "[    .    1    .    2]" 1 
        601 1  31 SER H    1  32 PHE QD   . . 5.020 4.707 4.409 4.944     .  0 0 "[    .    1    .    2]" 1 
        602 1  31 SER H    1  71 THR HA   . . 4.870 4.804 4.690 4.873 0.003  3 0 "[    .    1    .    2]" 1 
        603 1  31 SER H    1  71 THR MG   . . 4.320 3.334 3.180 3.476     .  0 0 "[    .    1    .    2]" 1 
        604 1  31 SER HA   1  32 PHE H    . . 2.780 2.322 2.268 2.372     .  0 0 "[    .    1    .    2]" 1 
        605 1  31 SER HA   1  32 PHE QD   . . 4.310 3.283 2.816 3.758     .  0 0 "[    .    1    .    2]" 1 
        606 1  31 SER HA   1  70 VAL H    . . 4.990 4.808 4.596 4.923     .  0 0 "[    .    1    .    2]" 1 
        607 1  31 SER HA   1  71 THR HA   . . 3.400 2.226 2.090 2.319     .  0 0 "[    .    1    .    2]" 1 
        608 1  31 SER HA   1  71 THR HB   . . 4.830 4.477 4.302 4.675     .  0 0 "[    .    1    .    2]" 1 
        609 1  31 SER HA   1  71 THR MG   . . 3.850 2.148 2.018 2.345     .  0 0 "[    .    1    .    2]" 1 
        610 1  31 SER HA   1  72 TYR H    . . 3.980 3.697 3.502 3.807     .  0 0 "[    .    1    .    2]" 1 
        611 1  31 SER HB2  1  32 PHE H    . . 3.330 2.789 2.596 2.932     .  0 0 "[    .    1    .    2]" 1 
        612 1  31 SER HB2  1  69 ASN HD21 . . 4.810 3.483 3.214 3.723     .  0 0 "[    .    1    .    2]" 1 
        613 1  31 SER HB2  1  69 ASN HD22 . . 4.330 2.516 2.184 2.757     .  0 0 "[    .    1    .    2]" 1 
        614 1  31 SER HB2  1  70 VAL H    . . 4.840 4.495 4.111 4.745     .  0 0 "[    .    1    .    2]" 1 
        615 1  31 SER HB2  1  71 THR HA   . . 4.040 3.645 3.463 3.827     .  0 0 "[    .    1    .    2]" 1 
        616 1  31 SER HB2  1  71 THR MG   . . 3.710 2.569 2.421 2.986     .  0 0 "[    .    1    .    2]" 1 
        617 1  31 SER HB2  1  72 TYR H    . . 5.500 5.403 5.205 5.500 0.000 11 0 "[    .    1    .    2]" 1 
        618 1  31 SER HB3  1  32 PHE H    . . 4.160 4.075 3.922 4.165 0.005 20 0 "[    .    1    .    2]" 1 
        619 1  31 SER HB3  1  69 ASN HD22 . . 4.480 4.079 3.754 4.300     .  0 0 "[    .    1    .    2]" 1 
        620 1  31 SER HB3  1  71 THR HA   . . 4.130 4.001 3.545 4.131 0.001  9 0 "[    .    1    .    2]" 1 
        621 1  31 SER HB3  1  71 THR MG   . . 3.750 1.961 1.924 2.006     .  0 0 "[    .    1    .    2]" 1 
        622 1  31 SER HB3  1  72 TYR H    . . 5.360 5.097 4.760 5.245     .  0 0 "[    .    1    .    2]" 1 
        623 1  32 PHE H    1  32 PHE QD   . . 3.660 3.076 2.810 3.315     .  0 0 "[    .    1    .    2]" 1 
        624 1  32 PHE H    1  32 PHE QE   . . 4.720 4.413 4.285 4.553     .  0 0 "[    .    1    .    2]" 1 
        625 1  32 PHE H    1  33 LEU QD   . . 5.440 5.006 4.809 5.378     .  0 0 "[    .    1    .    2]" 1 
        626 1  32 PHE H    1  69 ASN HA   . . 4.710 4.591 4.396 4.709     .  0 0 "[    .    1    .    2]" 1 
        627 1  32 PHE H    1  70 VAL H    . . 3.330 3.128 2.907 3.294     .  0 0 "[    .    1    .    2]" 1 
        628 1  32 PHE H    1  70 VAL HB   . . 4.110 3.950 3.658 4.103     .  0 0 "[    .    1    .    2]" 1 
        629 1  32 PHE H    1  70 VAL MG1  . . 4.700 4.590 4.411 4.701 0.001  7 0 "[    .    1    .    2]" 1 
        630 1  32 PHE H    1  70 VAL MG2  . . 5.170 5.001 4.734 5.138     .  0 0 "[    .    1    .    2]" 1 
        631 1  32 PHE H    1  71 THR HA   . . 4.180 3.668 3.498 3.833     .  0 0 "[    .    1    .    2]" 1 
        632 1  32 PHE H    1  71 THR MG   . . 4.420 4.042 3.932 4.237     .  0 0 "[    .    1    .    2]" 1 
        633 1  32 PHE HA   1  32 PHE QD   . . 4.230 3.724 3.699 3.728     .  0 0 "[    .    1    .    2]" 1 
        634 1  32 PHE HA   1  33 LEU H    . . 2.850 2.194 2.179 2.251     .  0 0 "[    .    1    .    2]" 1 
        635 1  32 PHE HA   1  33 LEU QB   . . 4.720 3.978 3.943 3.994     .  0 0 "[    .    1    .    2]" 1 
        636 1  32 PHE HA   1  33 LEU QD   . . 5.440 4.920 4.812 5.073     .  0 0 "[    .    1    .    2]" 1 
        637 1  32 PHE HB2  1  33 LEU H    . . 3.120 3.060 2.845 3.121 0.001  8 0 "[    .    1    .    2]" 1 
        638 1  32 PHE HB3  1  33 LEU H    . . 4.130 4.099 3.987 4.130 0.000  4 0 "[    .    1    .    2]" 1 
        639 1  32 PHE QD   1  33 LEU H    . . 4.080 3.951 3.652 4.080 0.000 14 0 "[    .    1    .    2]" 1 
        640 1  32 PHE QD   1  34 VAL MG2  . . 3.240 2.388 2.186 2.660     .  0 0 "[    .    1    .    2]" 1 
        641 1  32 PHE QD   1  70 VAL HB   . . 4.730 3.503 3.391 3.605     .  0 0 "[    .    1    .    2]" 1 
        642 1  32 PHE QD   1  71 THR HA   . . 4.760 4.014 3.632 4.541     .  0 0 "[    .    1    .    2]" 1 
        643 1  32 PHE QD   1  82 LEU MD2  . . 4.210 3.862 3.707 4.041     .  0 0 "[    .    1    .    2]" 1 
        644 1  32 PHE QD   1  84 VAL MG2  . . 4.790 4.470 4.207 4.738     .  0 0 "[    .    1    .    2]" 1 
        645 1  32 PHE QE   1  34 VAL MG2  . . 3.030 2.643 2.127 2.950     .  0 0 "[    .    1    .    2]" 1 
        646 1  32 PHE QE   1  46 ILE MD   . . 3.730 2.742 2.483 2.983     .  0 0 "[    .    1    .    2]" 1 
        647 1  32 PHE QE   1  70 VAL HB   . . 4.280 2.710 2.452 2.908     .  0 0 "[    .    1    .    2]" 1 
        648 1  32 PHE QE   1  70 VAL MG1  . . 3.810 2.485 2.227 2.775     .  0 0 "[    .    1    .    2]" 1 
        649 1  32 PHE QE   1  70 VAL MG2  . . 3.580 2.956 2.754 3.257     .  0 0 "[    .    1    .    2]" 1 
        650 1  32 PHE QE   1  72 TYR QD   . . 3.670 2.225 2.007 2.593     .  0 0 "[    .    1    .    2]" 1 
        651 1  32 PHE QE   1  72 TYR QE   . . 3.450 2.277 2.002 2.632     .  0 0 "[    .    1    .    2]" 1 
        652 1  32 PHE QE   1  82 LEU MD1  . . 4.150 3.201 2.843 3.566     .  0 0 "[    .    1    .    2]" 1 
        653 1  32 PHE QE   1  82 LEU MD2  . . 3.760 3.511 3.285 3.699     .  0 0 "[    .    1    .    2]" 1 
        654 1  32 PHE QE   1  84 VAL MG1  . . 3.860 3.547 3.221 3.776     .  0 0 "[    .    1    .    2]" 1 
        655 1  32 PHE QE   1  84 VAL MG2  . . 3.390 3.182 2.944 3.390     .  0 0 "[    .    1    .    2]" 1 
        656 1  32 PHE HZ   1  46 ILE MD   . . 3.930 2.559 2.007 3.065     .  0 0 "[    .    1    .    2]" 1 
        657 1  32 PHE HZ   1  46 ILE MG   . . 3.780 3.255 2.879 3.500     .  0 0 "[    .    1    .    2]" 1 
        658 1  32 PHE HZ   1  58 VAL MG1  . . 4.700 4.335 3.966 4.699     .  0 0 "[    .    1    .    2]" 1 
        659 1  32 PHE HZ   1  70 VAL MG1  . . 3.210 2.011 1.879 2.256     .  0 0 "[    .    1    .    2]" 1 
        660 1  32 PHE HZ   1  70 VAL MG2  . . 4.100 3.381 3.119 3.633     .  0 0 "[    .    1    .    2]" 1 
        661 1  32 PHE HZ   1  82 LEU MD1  . . 3.270 2.999 2.521 3.179     .  0 0 "[    .    1    .    2]" 1 
        662 1  32 PHE HZ   1  82 LEU MD2  . . 4.470 3.847 3.451 4.103     .  0 0 "[    .    1    .    2]" 1 
        663 1  32 PHE HZ   1  84 VAL MG2  . . 3.860 3.593 3.210 3.837     .  0 0 "[    .    1    .    2]" 1 
        664 1  33 LEU H    1  33 LEU QB   . . 3.050 2.380 2.345 2.434     .  0 0 "[    .    1    .    2]" 1 
        665 1  33 LEU H    1  33 LEU QD   . . 4.520 3.703 3.623 3.802     .  0 0 "[    .    1    .    2]" 1 
        666 1  33 LEU HA   1  33 LEU QD   . . 3.260 2.102 1.883 2.526     .  0 0 "[    .    1    .    2]" 1 
        667 1  33 LEU HA   1  33 LEU HG   . . 4.000 3.255 2.608 3.726     .  0 0 "[    .    1    .    2]" 1 
        668 1  33 LEU HA   1  34 VAL H    . . 2.740 2.251 2.185 2.309     .  0 0 "[    .    1    .    2]" 1 
        669 1  33 LEU HA   1  34 VAL HB   . . 4.700 4.587 4.376 4.690     .  0 0 "[    .    1    .    2]" 1 
        670 1  33 LEU HA   1  34 VAL MG2  . . 4.500 3.527 3.296 3.838     .  0 0 "[    .    1    .    2]" 1 
        671 1  33 LEU HA   1  68 TYR H    . . 4.450 4.206 4.010 4.404     .  0 0 "[    .    1    .    2]" 1 
        672 1  33 LEU HA   1  69 ASN HA   . . 3.640 2.915 2.569 3.108     .  0 0 "[    .    1    .    2]" 1 
        673 1  33 LEU HA   1  70 VAL H    . . 3.960 3.512 3.328 3.755     .  0 0 "[    .    1    .    2]" 1 
        674 1  33 LEU HA   1  70 VAL MG2  . . 4.790 4.486 4.021 4.782     .  0 0 "[    .    1    .    2]" 1 
        675 1  33 LEU QB   1  33 LEU MD1  . . 3.190 2.160 2.002 2.284     .  0 0 "[    .    1    .    2]" 1 
        676 1  33 LEU QB   1  33 LEU QD   . . 2.690 1.927 1.786 2.040     .  0 0 "[    .    1    .    2]" 1 
        677 1  33 LEU QB   1  33 LEU MD2  . . 3.190 2.188 1.948 2.421     .  0 0 "[    .    1    .    2]" 1 
        678 1  33 LEU QB   1  34 VAL H    . . 3.560 3.460 3.321 3.581 0.021 11 0 "[    .    1    .    2]" 1 
        679 1  33 LEU QB   1  69 ASN HA   . . 4.510 4.070 3.460 4.441     .  0 0 "[    .    1    .    2]" 1 
        680 1  33 LEU QB   1  69 ASN HD21 . . 5.500 5.144 4.724 5.448     .  0 0 "[    .    1    .    2]" 1 
        681 1  33 LEU QB   1  69 ASN HD22 . . 5.480 4.994 4.621 5.305     .  0 0 "[    .    1    .    2]" 1 
        682 1  33 LEU QD   1  34 VAL H    . . 3.290 2.316 1.753 3.087     .  0 0 "[    .    1    .    2]" 1 
        683 1  33 LEU QD   1  35 ASP QB   . . 3.890 3.552 2.992 3.890 0.000  2 0 "[    .    1    .    2]" 1 
        684 1  33 LEU QD   1  67 GLN HA   . . 3.910 2.826 2.360 3.662     .  0 0 "[    .    1    .    2]" 1 
        685 1  33 LEU QD   1  67 GLN HB2  . . 4.180 2.950 2.712 3.267     .  0 0 "[    .    1    .    2]" 1 
        686 1  33 LEU QD   1  67 GLN HB3  . . 3.240 1.875 1.788 2.113     .  0 0 "[    .    1    .    2]" 1 
        687 1  33 LEU QD   1  67 GLN QE   . . 4.070 2.909 2.071 3.918     .  0 0 "[    .    1    .    2]" 1 
        688 1  33 LEU QD   1  67 GLN HG2  . . 3.440 2.362 2.083 2.828     .  0 0 "[    .    1    .    2]" 1 
        689 1  33 LEU QD   1  67 GLN HG3  . . 4.360 3.579 3.435 3.738     .  0 0 "[    .    1    .    2]" 1 
        690 1  33 LEU QD   1  68 TYR H    . . 4.130 2.419 1.855 3.221     .  0 0 "[    .    1    .    2]" 1 
        691 1  33 LEU QD   1  69 ASN H    . . 3.970 3.207 2.965 3.375     .  0 0 "[    .    1    .    2]" 1 
        692 1  33 LEU QD   1  69 ASN HA   . . 3.320 2.194 1.970 2.380     .  0 0 "[    .    1    .    2]" 1 
        693 1  33 LEU QD   1  69 ASN HB2  . . 3.420 2.896 2.650 3.190     .  0 0 "[    .    1    .    2]" 1 
        694 1  33 LEU QD   1  69 ASN HB3  . . 4.340 4.028 3.823 4.278     .  0 0 "[    .    1    .    2]" 1 
        695 1  33 LEU QD   1  69 ASN HD21 . . 4.060 3.799 3.518 4.022     .  0 0 "[    .    1    .    2]" 1 
        696 1  33 LEU QD   1  69 ASN HD22 . . 4.310 4.080 3.711 4.270     .  0 0 "[    .    1    .    2]" 1 
        697 1  33 LEU QD   1  70 VAL H    . . 4.560 3.739 3.566 3.981     .  0 0 "[    .    1    .    2]" 1 
        698 1  33 LEU MD1  1  34 VAL H    . . 3.860 2.437 1.836 3.276     .  0 0 "[    .    1    .    2]" 1 
        699 1  33 LEU MD1  1  67 GLN H    . . 5.500 4.826 4.577 5.449     .  0 0 "[    .    1    .    2]" 1 
        700 1  33 LEU MD1  1  67 GLN HA   . . 5.380 3.068 2.388 4.519     .  0 0 "[    .    1    .    2]" 1 
        701 1  33 LEU MD1  1  67 GLN HB2  . . 4.880 3.358 2.952 3.697     .  0 0 "[    .    1    .    2]" 1 
        702 1  33 LEU MD1  1  67 GLN HB3  . . 3.880 2.121 1.920 2.758     .  0 0 "[    .    1    .    2]" 1 
        703 1  33 LEU MD1  1  68 TYR H    . . 4.770 2.560 1.872 3.356     .  0 0 "[    .    1    .    2]" 1 
        704 1  33 LEU MD2  1  34 VAL H    . . 3.860 3.023 1.941 3.839     .  0 0 "[    .    1    .    2]" 1 
        705 1  33 LEU MD2  1  67 GLN H    . . 5.500 5.115 4.918 5.410     .  0 0 "[    .    1    .    2]" 1 
        706 1  33 LEU MD2  1  67 GLN HA   . . 5.380 3.598 3.216 3.925     .  0 0 "[    .    1    .    2]" 1 
        707 1  33 LEU MD2  1  67 GLN HB2  . . 4.880 3.294 2.986 3.710     .  0 0 "[    .    1    .    2]" 1 
        708 1  33 LEU MD2  1  67 GLN HB3  . . 3.880 2.143 1.917 2.506     .  0 0 "[    .    1    .    2]" 1 
        709 1  33 LEU MD2  1  68 TYR H    . . 4.770 3.233 2.140 4.148     .  0 0 "[    .    1    .    2]" 1 
        710 1  33 LEU HG   1  34 VAL H    . . 4.430 3.275 1.941 4.366     .  0 0 "[    .    1    .    2]" 1 
        711 1  33 LEU HG   1  67 GLN HB2  . . 5.500 4.524 4.062 4.956     .  0 0 "[    .    1    .    2]" 1 
        712 1  33 LEU HG   1  67 GLN HG2  . . 5.120 4.013 3.578 4.415     .  0 0 "[    .    1    .    2]" 1 
        713 1  34 VAL H    1  34 VAL HB   . . 3.340 2.703 2.596 2.816     .  0 0 "[    .    1    .    2]" 1 
        714 1  34 VAL H    1  34 VAL MG1  . . 4.040 3.873 3.772 3.928     .  0 0 "[    .    1    .    2]" 1 
        715 1  34 VAL H    1  34 VAL MG2  . . 3.420 2.847 2.673 3.160     .  0 0 "[    .    1    .    2]" 1 
        716 1  34 VAL H    1  67 GLN HA   . . 4.330 4.084 3.872 4.318     .  0 0 "[    .    1    .    2]" 1 
        717 1  34 VAL H    1  68 TYR H    . . 3.590 2.573 2.351 2.748     .  0 0 "[    .    1    .    2]" 1 
        718 1  34 VAL H    1  68 TYR HB2  . . 4.270 3.414 3.121 3.693     .  0 0 "[    .    1    .    2]" 1 
        719 1  34 VAL H    1  68 TYR HB3  . . 4.970 4.647 4.325 4.916     .  0 0 "[    .    1    .    2]" 1 
        720 1  34 VAL H    1  68 TYR QD   . . 5.020 4.618 4.320 4.853     .  0 0 "[    .    1    .    2]" 1 
        721 1  34 VAL H    1  69 ASN HA   . . 4.330 4.257 4.098 4.330 0.000 18 0 "[    .    1    .    2]" 1 
        722 1  34 VAL H    1  70 VAL MG2  . . 5.020 4.638 4.428 4.896     .  0 0 "[    .    1    .    2]" 1 
        723 1  34 VAL HA   1  34 VAL MG1  . . 3.310 2.369 2.258 2.465     .  0 0 "[    .    1    .    2]" 1 
        724 1  34 VAL HA   1  34 VAL MG2  . . 3.430 2.348 2.186 2.449     .  0 0 "[    .    1    .    2]" 1 
        725 1  34 VAL HA   1  35 ASP H    . . 3.200 2.145 2.139 2.161     .  0 0 "[    .    1    .    2]" 1 
        726 1  34 VAL HA   1  35 ASP HA   . . 4.570 4.401 4.382 4.414     .  0 0 "[    .    1    .    2]" 1 
        727 1  34 VAL HB   1  35 ASP H    . . 4.630 4.298 4.191 4.448     .  0 0 "[    .    1    .    2]" 1 
        728 1  34 VAL HB   1  44 LEU MD1  . . 3.580 3.356 3.092 3.574     .  0 0 "[    .    1    .    2]" 1 
        729 1  34 VAL HB   1  44 LEU MD2  . . 3.670 2.140 1.919 2.405     .  0 0 "[    .    1    .    2]" 1 
        730 1  34 VAL HB   1  68 TYR H    . . 3.750 3.488 3.212 3.725     .  0 0 "[    .    1    .    2]" 1 
        731 1  34 VAL HB   1  68 TYR HB2  . . 3.730 2.550 2.301 2.747     .  0 0 "[    .    1    .    2]" 1 
        732 1  34 VAL HB   1  68 TYR HB3  . . 4.470 4.094 3.772 4.389     .  0 0 "[    .    1    .    2]" 1 
        733 1  34 VAL HB   1  68 TYR QD   . . 3.800 3.517 3.126 3.738     .  0 0 "[    .    1    .    2]" 1 
        734 1  34 VAL HB   1  70 VAL MG2  . . 4.540 4.380 4.140 4.541 0.001  5 0 "[    .    1    .    2]" 1 
        735 1  34 VAL MG1  1  35 ASP H    . . 3.480 2.799 2.285 3.041     .  0 0 "[    .    1    .    2]" 1 
        736 1  34 VAL MG1  1  44 LEU MD2  . . 3.450 2.492 2.268 2.813     .  0 0 "[    .    1    .    2]" 1 
        737 1  34 VAL MG1  1  68 TYR QD   . . 4.650 3.777 3.017 4.125     .  0 0 "[    .    1    .    2]" 1 
        738 1  34 VAL MG2  1  35 ASP H    . . 4.530 4.123 3.936 4.197     .  0 0 "[    .    1    .    2]" 1 
        739 1  34 VAL MG2  1  44 LEU MD2  . . 3.690 2.359 1.972 2.711     .  0 0 "[    .    1    .    2]" 1 
        740 1  34 VAL MG2  1  68 TYR H    . . 4.920 4.494 4.233 4.744     .  0 0 "[    .    1    .    2]" 1 
        741 1  34 VAL MG2  1  68 TYR HB2  . . 4.110 3.616 3.299 3.874     .  0 0 "[    .    1    .    2]" 1 
        742 1  34 VAL MG2  1  70 VAL MG2  . . 3.470 3.254 2.962 3.462     .  0 0 "[    .    1    .    2]" 1 
        743 1  35 ASP H    1  35 ASP HB2  . . 3.680 2.735 2.220 3.082     .  0 0 "[    .    1    .    2]" 1 
        744 1  35 ASP H    1  35 ASP QB   . . 3.160 2.312 2.164 2.753     .  0 0 "[    .    1    .    2]" 1 
        745 1  35 ASP H    1  35 ASP HB3  . . 3.680 2.683 2.217 3.625     .  0 0 "[    .    1    .    2]" 1 
        746 1  35 ASP HA   1  36 CYS H    . . 2.920 2.146 2.139 2.179     .  0 0 "[    .    1    .    2]" 1 
        747 1  35 ASP HA   1  37 SER H    . . 4.010 3.736 3.442 4.000     .  0 0 "[    .    1    .    2]" 1 
        748 1  35 ASP HA   1  67 GLN HA   . . 3.750 2.928 2.752 3.160     .  0 0 "[    .    1    .    2]" 1 
        749 1  35 ASP HA   1  67 GLN HB3  . . 4.910 4.655 4.185 4.909     .  0 0 "[    .    1    .    2]" 1 
        750 1  35 ASP HA   1  67 GLN HG2  . . 4.050 3.382 2.967 3.660     .  0 0 "[    .    1    .    2]" 1 
        751 1  35 ASP HA   1  67 GLN HG3  . . 4.500 4.364 3.988 4.501 0.001 13 0 "[    .    1    .    2]" 1 
        752 1  35 ASP HA   1  68 TYR H    . . 4.430 4.195 3.948 4.384     .  0 0 "[    .    1    .    2]" 1 
        753 1  35 ASP QB   1  36 CYS H    . . 3.930 3.693 3.110 3.909     .  0 0 "[    .    1    .    2]" 1 
        754 1  35 ASP QB   1  67 GLN HG2  . . 4.360 3.806 3.308 4.324     .  0 0 "[    .    1    .    2]" 1 
        755 1  35 ASP HB2  1  36 CYS H    . . 4.740 4.250 3.955 4.452     .  0 0 "[    .    1    .    2]" 1 
        756 1  35 ASP HB3  1  36 CYS H    . . 4.740 4.114 3.192 4.498     .  0 0 "[    .    1    .    2]" 1 
        757 1  36 CYS H    1  36 CYS QB   . . 3.420 2.689 2.377 3.019     .  0 0 "[    .    1    .    2]" 1 
        758 1  36 CYS H    1  36 CYS HG   . . 4.070 3.378 1.974 4.069     .  0 0 "[    .    1    .    2]" 1 
        759 1  36 CYS H    1  37 SER H    . . 3.250 2.557 2.125 2.862     .  0 0 "[    .    1    .    2]" 1 
        760 1  36 CYS H    1  37 SER HA   . . 5.160 4.353 4.182 4.570     .  0 0 "[    .    1    .    2]" 1 
        761 1  36 CYS H    1  37 SER QB   . . 5.340 4.134 3.662 4.542     .  0 0 "[    .    1    .    2]" 1 
        762 1  36 CYS H    1  66 GLN HB2  . . 4.130 3.496 3.106 3.901     .  0 0 "[    .    1    .    2]" 1 
        763 1  36 CYS H    1  67 GLN HA   . . 3.970 3.692 3.177 3.967     .  0 0 "[    .    1    .    2]" 1 
        764 1  36 CYS H    1  68 TYR H    . . 5.250 5.004 4.780 5.234     .  0 0 "[    .    1    .    2]" 1 
        765 1  36 CYS H    1  68 TYR QD   . . 4.420 4.185 3.879 4.419     .  0 0 "[    .    1    .    2]" 1 
        766 1  36 CYS H    1  68 TYR QE   . . 4.870 4.545 4.098 4.868     .  0 0 "[    .    1    .    2]" 1 
        767 1  36 CYS HA   1  36 CYS HG   . . 4.520 3.951 3.389 4.517     .  0 0 "[    .    1    .    2]" 1 
        768 1  36 CYS HA   1  38 LYS H    . . 4.700 4.131 3.317 4.627     .  0 0 "[    .    1    .    2]" 1 
        769 1  36 CYS HA   1  39 ALA H    . . 3.610 3.360 3.043 3.609     .  0 0 "[    .    1    .    2]" 1 
        770 1  36 CYS HA   1  39 ALA MB   . . 3.780 2.238 2.039 2.645     .  0 0 "[    .    1    .    2]" 1 
        771 1  36 CYS QB   1  39 ALA MB   . . 3.610 2.382 1.937 2.853     .  0 0 "[    .    1    .    2]" 1 
        772 1  36 CYS QB   1  66 GLN HB2  . . 5.130 4.858 4.325 5.132 0.002 18 0 "[    .    1    .    2]" 1 
        773 1  36 CYS QB   1  66 GLN HB3  . . 4.380 3.514 2.816 4.069     .  0 0 "[    .    1    .    2]" 1 
        774 1  36 CYS QB   1  68 TYR QE   . . 3.700 2.902 2.223 3.696     .  0 0 "[    .    1    .    2]" 1 
        775 1  36 CYS QB   1  86 TRP HH2  . . 4.190 2.853 2.245 3.643     .  0 0 "[    .    1    .    2]" 1 
        776 1  36 CYS QB   1  86 TRP HZ2  . . 4.750 3.127 2.504 3.656     .  0 0 "[    .    1    .    2]" 1 
        777 1  36 CYS QB   1  86 TRP HZ3  . . 4.230 3.633 3.007 4.138     .  0 0 "[    .    1    .    2]" 1 
        778 1  36 CYS HB2  1  39 ALA MB   . . 4.200 3.284 1.952 4.136     .  0 0 "[    .    1    .    2]" 1 
        779 1  36 CYS HB2  1  68 TYR QE   . . 4.560 3.196 2.245 4.443     .  0 0 "[    .    1    .    2]" 1 
        780 1  36 CYS HB2  1  86 TRP HH2  . . 4.830 3.375 2.293 4.066     .  0 0 "[    .    1    .    2]" 1 
        781 1  36 CYS HB2  1  86 TRP HZ3  . . 4.800 4.201 3.472 4.799     .  0 0 "[    .    1    .    2]" 1 
        782 1  36 CYS HB3  1  39 ALA MB   . . 4.200 2.803 1.972 3.921     .  0 0 "[    .    1    .    2]" 1 
        783 1  36 CYS HB3  1  68 TYR QE   . . 4.560 3.821 3.451 4.214     .  0 0 "[    .    1    .    2]" 1 
        784 1  36 CYS HB3  1  86 TRP HH2  . . 4.830 3.245 2.454 4.586     .  0 0 "[    .    1    .    2]" 1 
        785 1  36 CYS HB3  1  86 TRP HZ3  . . 4.800 3.991 3.238 4.622     .  0 0 "[    .    1    .    2]" 1 
        786 1  36 CYS HG   1  68 TYR QD   . . 4.820 2.850 2.008 4.819     .  0 0 "[    .    1    .    2]" 1 
        787 1  36 CYS HG   1  68 TYR QE   . . 4.420 3.006 2.017 3.765     .  0 0 "[    .    1    .    2]" 1 
        788 1  36 CYS HG   1  86 TRP HZ3  . . 4.780 4.073 2.863 4.768     .  0 0 "[    .    1    .    2]" 1 
        789 1  37 SER H    1  37 SER HB2  . . 3.670 2.689 2.195 3.598     .  0 0 "[    .    1    .    2]" 1 
        790 1  37 SER H    1  37 SER QB   . . 3.050 2.320 2.174 2.727     .  0 0 "[    .    1    .    2]" 1 
        791 1  37 SER H    1  37 SER HB3  . . 3.670 2.790 2.358 3.590     .  0 0 "[    .    1    .    2]" 1 
        792 1  37 SER H    1  38 LYS H    . . 3.580 2.780 2.543 3.113     .  0 0 "[    .    1    .    2]" 1 
        793 1  37 SER H    1  39 ALA H    . . 4.650 3.827 3.466 4.112     .  0 0 "[    .    1    .    2]" 1 
        794 1  37 SER H    1  66 GLN HB2  . . 4.030 3.555 3.186 3.850     .  0 0 "[    .    1    .    2]" 1 
        795 1  37 SER H    1  66 GLN HB3  . . 4.320 3.293 2.438 3.680     .  0 0 "[    .    1    .    2]" 1 
        796 1  37 SER HA   1  39 ALA H    . . 4.280 4.042 3.816 4.225     .  0 0 "[    .    1    .    2]" 1 
        797 1  37 SER HA   1  66 GLN HB2  . . 3.920 3.186 2.798 3.730     .  0 0 "[    .    1    .    2]" 1 
        798 1  37 SER HA   1  66 GLN HB3  . . 4.110 2.685 2.176 3.132     .  0 0 "[    .    1    .    2]" 1 
        799 1  37 SER HA   1  66 GLN HG2  . . 4.490 3.189 1.999 4.208     .  0 0 "[    .    1    .    2]" 1 
        800 1  37 SER HA   1  66 GLN HG3  . . 4.490 2.836 1.999 4.260     .  0 0 "[    .    1    .    2]" 1 
        801 1  37 SER QB   1  38 LYS H    . . 4.390 2.445 1.964 3.484     .  0 0 "[    .    1    .    2]" 1 
        802 1  37 SER QB   1  66 GLN HB2  . . 3.940 2.870 2.011 3.924     .  0 0 "[    .    1    .    2]" 1 
        803 1  37 SER QB   1  66 GLN HB3  . . 4.920 3.506 2.713 4.228     .  0 0 "[    .    1    .    2]" 1 
        804 1  37 SER QB   1  66 GLN QG   . . 4.560 3.109 1.987 3.840     .  0 0 "[    .    1    .    2]" 1 
        805 1  37 SER HB2  1  66 GLN HB2  . . 4.670 3.251 2.222 4.541     .  0 0 "[    .    1    .    2]" 1 
        806 1  37 SER HB3  1  66 GLN HB2  . . 4.670 4.007 2.020 4.670     .  0 0 "[    .    1    .    2]" 1 
        807 1  38 LYS H    1  38 LYS HB2  . . 3.930 2.778 2.183 3.742     .  0 0 "[    .    1    .    2]" 1 
        808 1  38 LYS H    1  38 LYS QB   . . 3.380 2.456 2.162 2.818     .  0 0 "[    .    1    .    2]" 1 
        809 1  38 LYS H    1  38 LYS HB3  . . 3.930 3.348 2.560 3.718     .  0 0 "[    .    1    .    2]" 1 
        810 1  38 LYS H    1  38 LYS QD   . . 4.120 3.706 1.889 4.100     .  0 0 "[    .    1    .    2]" 1 
        811 1  38 LYS H    1  38 LYS QE   . . 5.390 4.257 2.772 5.259     .  0 0 "[    .    1    .    2]" 1 
        812 1  38 LYS H    1  38 LYS QG   . . 3.180 2.529 1.889 3.201 0.021 12 0 "[    .    1    .    2]" 1 
        813 1  38 LYS H    1  39 ALA H    . . 2.870 2.694 2.268 2.866     .  0 0 "[    .    1    .    2]" 1 
        814 1  38 LYS H    1  39 ALA MB   . . 4.340 4.029 3.745 4.312     .  0 0 "[    .    1    .    2]" 1 
        815 1  38 LYS HA   1  38 LYS HG2  . . 4.060 3.112 2.442 3.709     .  0 0 "[    .    1    .    2]" 1 
        816 1  38 LYS HA   1  38 LYS QG   . . 3.490 2.811 2.242 3.343     .  0 0 "[    .    1    .    2]" 1 
        817 1  38 LYS HA   1  38 LYS HG3  . . 4.060 3.402 2.269 3.907     .  0 0 "[    .    1    .    2]" 1 
        818 1  38 LYS QB   1  38 LYS QD   . . 3.480 2.245 2.045 2.631     .  0 0 "[    .    1    .    2]" 1 
        819 1  38 LYS QB   1  39 ALA H    . . 4.200 3.554 2.859 4.042     .  0 0 "[    .    1    .    2]" 1 
        820 1  38 LYS QE   1  38 LYS QG   . . 3.260 2.265 2.102 2.545     .  0 0 "[    .    1    .    2]" 1 
        821 1  38 LYS QG   1  39 ALA H    . . 5.220 4.053 2.366 4.736     .  0 0 "[    .    1    .    2]" 1 
        822 1  39 ALA H    1  39 ALA MB   . . 2.870 2.183 2.027 2.366     .  0 0 "[    .    1    .    2]" 1 
        823 1  39 ALA H    1  40 GLY H    . . 3.070 2.685 2.291 3.061     .  0 0 "[    .    1    .    2]" 1 
        824 1  39 ALA H    1  40 GLY HA2  . . 5.290 4.749 4.391 5.068     .  0 0 "[    .    1    .    2]" 1 
        825 1  39 ALA HA   1  86 TRP HE1  . . 4.590 4.309 3.887 4.581     .  0 0 "[    .    1    .    2]" 1 
        826 1  39 ALA MB   1  40 GLY H    . . 3.850 2.218 2.004 2.500     .  0 0 "[    .    1    .    2]" 1 
        827 1  39 ALA MB   1  86 TRP HD1  . . 4.240 3.885 3.509 4.199     .  0 0 "[    .    1    .    2]" 1 
        828 1  39 ALA MB   1  86 TRP HE1  . . 3.250 2.528 2.075 2.997     .  0 0 "[    .    1    .    2]" 1 
        829 1  39 ALA MB   1  86 TRP HZ2  . . 4.240 2.720 2.081 3.215     .  0 0 "[    .    1    .    2]" 1 
        830 1  40 GLY H    1  40 GLY HA2  . . 2.890 2.720 2.660 2.777     .  0 0 "[    .    1    .    2]" 1 
        831 1  40 GLY H    1  41 SER H    . . 4.330 4.119 3.371 4.399 0.069  3 0 "[    .    1    .    2]" 1 
        832 1  40 GLY H    1  41 SER HA   . . 5.440 4.569 4.251 4.687     .  0 0 "[    .    1    .    2]" 1 
        833 1  40 GLY HA2  1  41 SER HA   . . 5.500 4.499 4.327 4.782     .  0 0 "[    .    1    .    2]" 1 
        834 1  40 GLY HA3  1  41 SER H    . . 2.920 2.385 2.143 2.708     .  0 0 "[    .    1    .    2]" 1 
        835 1  41 SER H    1  41 SER HB2  . . 3.980 3.065 2.274 3.835     .  0 0 "[    .    1    .    2]" 1 
        836 1  41 SER H    1  41 SER QB   . . 3.450 2.669 2.248 3.110     .  0 0 "[    .    1    .    2]" 1 
        837 1  41 SER H    1  41 SER HB3  . . 3.980 3.332 2.701 3.893     .  0 0 "[    .    1    .    2]" 1 
        838 1  41 SER H    1  42 ASN H    . . 4.470 3.120 2.347 3.856     .  0 0 "[    .    1    .    2]" 1 
        839 1  41 SER H    1  86 TRP HH2  . . 5.500 5.298 4.928 5.486     .  0 0 "[    .    1    .    2]" 1 
        840 1  41 SER HA   1  42 ASN H    . . 3.170 2.629 2.141 3.027     .  0 0 "[    .    1    .    2]" 1 
        841 1  41 SER HA   1  86 TRP HZ2  . . 4.330 4.012 3.365 4.322     .  0 0 "[    .    1    .    2]" 1 
        842 1  41 SER QB   1  42 ASN H    . . 4.070 3.887 3.579 4.055     .  0 0 "[    .    1    .    2]" 1 
        843 1  41 SER HB2  1  42 ASN H    . . 4.700 4.400 3.971 4.656     .  0 0 "[    .    1    .    2]" 1 
        844 1  41 SER HB3  1  42 ASN H    . . 4.700 4.375 3.745 4.652     .  0 0 "[    .    1    .    2]" 1 
        845 1  42 ASN H    1  42 ASN HB2  . . 4.010 2.553 2.222 3.255     .  0 0 "[    .    1    .    2]" 1 
        846 1  42 ASN H    1  42 ASN HB3  . . 4.030 3.219 2.774 3.675     .  0 0 "[    .    1    .    2]" 1 
        847 1  42 ASN H    1  43 MET H    . . 4.720 4.450 4.365 4.517     .  0 0 "[    .    1    .    2]" 1 
        848 1  42 ASN H    1  86 TRP HE1  . . 5.440 4.641 4.156 5.428     .  0 0 "[    .    1    .    2]" 1 
        849 1  42 ASN H    1  86 TRP HH2  . . 3.580 2.718 2.179 3.367     .  0 0 "[    .    1    .    2]" 1 
        850 1  42 ASN HA   1  42 ASN QD   . . 4.450 3.393 2.574 3.938     .  0 0 "[    .    1    .    2]" 1 
        851 1  42 ASN HA   1  43 MET H    . . 3.300 2.605 2.531 2.650     .  0 0 "[    .    1    .    2]" 1 
        852 1  42 ASN HB2  1  42 ASN HD22 . . 3.860 3.549 3.439 3.917 0.057 19 0 "[    .    1    .    2]" 1 
        853 1  42 ASN HB2  1  43 MET H    . . 4.060 3.670 3.481 3.810     .  0 0 "[    .    1    .    2]" 1 
        854 1  42 ASN HB2  1  86 TRP HE1  . . 4.180 3.618 3.270 4.020     .  0 0 "[    .    1    .    2]" 1 
        855 1  42 ASN HB2  1  87 GLY H    . . 5.500 5.296 4.691 5.501 0.001 18 0 "[    .    1    .    2]" 1 
        856 1  42 ASN HB3  1  43 MET H    . . 3.520 2.499 1.963 2.925     .  0 0 "[    .    1    .    2]" 1 
        857 1  42 ASN HB3  1  86 TRP HA   . . 4.760 4.648 4.381 4.767 0.007 19 0 "[    .    1    .    2]" 1 
        858 1  42 ASN HB3  1  86 TRP HE3  . . 4.860 4.264 3.852 4.787     .  0 0 "[    .    1    .    2]" 1 
        859 1  42 ASN HB3  1  87 GLY H    . . 4.300 4.017 3.589 4.299     .  0 0 "[    .    1    .    2]" 1 
        860 1  42 ASN QD   1  43 MET H    . . 5.190 3.753 3.134 4.384     .  0 0 "[    .    1    .    2]" 1 
        861 1  42 ASN QD   1  87 GLY HA2  . . 3.620 3.262 2.311 3.616     .  0 0 "[    .    1    .    2]" 1 
        862 1  42 ASN QD   1  87 GLY HA3  . . 4.090 2.262 1.880 2.708     .  0 0 "[    .    1    .    2]" 1 
        863 1  42 ASN QD   1  88 GLU H    . . 5.340 4.963 4.507 5.232     .  0 0 "[    .    1    .    2]" 1 
        864 1  43 MET H    1  43 MET QB   . . 3.250 2.769 2.609 2.869     .  0 0 "[    .    1    .    2]" 1 
        865 1  43 MET H    1  43 MET ME   . . 4.920 4.513 2.855 4.897     .  0 0 "[    .    1    .    2]" 1 
        866 1  43 MET H    1  43 MET QG   . . 3.450 2.138 1.917 2.305     .  0 0 "[    .    1    .    2]" 1 
        867 1  43 MET H    1  45 LEU QD   . . 5.440 5.371 5.103 5.442 0.002  3 0 "[    .    1    .    2]" 1 
        868 1  43 MET H    1  87 GLY H    . . 4.230 4.187 4.108 4.233 0.003 10 0 "[    .    1    .    2]" 1 
        869 1  43 MET H    1  87 GLY HA2  . . 4.890 3.770 3.345 4.220     .  0 0 "[    .    1    .    2]" 1 
        870 1  43 MET HA   1  43 MET ME   . . 4.190 4.113 3.988 4.187     .  0 0 "[    .    1    .    2]" 1 
        871 1  43 MET HA   1  44 LEU H    . . 3.100 2.250 2.163 2.586     .  0 0 "[    .    1    .    2]" 1 
        872 1  43 MET HA   1  44 LEU QB   . . 4.390 3.981 3.921 4.031     .  0 0 "[    .    1    .    2]" 1 
        873 1  43 MET QB   1  44 LEU H    . . 4.040 2.838 2.082 3.119     .  0 0 "[    .    1    .    2]" 1 
        874 1  43 MET HB2  1  43 MET ME   . . 4.020 2.218 1.984 3.593     .  0 0 "[    .    1    .    2]" 1 
        875 1  43 MET HB3  1  43 MET ME   . . 4.020 3.419 3.211 4.031 0.011  8 0 "[    .    1    .    2]" 1 
        876 1  43 MET ME   1  45 LEU HA   . . 4.000 3.711 3.382 3.998     .  0 0 "[    .    1    .    2]" 1 
        877 1  43 MET ME   1  45 LEU HB3  . . 2.900 2.134 1.905 2.691     .  0 0 "[    .    1    .    2]" 1 
        878 1  43 MET ME   1  45 LEU MD1  . . 4.460 3.558 2.810 4.461 0.001  4 0 "[    .    1    .    2]" 1 
        879 1  43 MET ME   1  45 LEU QD   . . 3.700 2.820 1.851 3.496     .  0 0 "[    .    1    .    2]" 1 
        880 1  43 MET ME   1  45 LEU MD2  . . 4.460 3.532 1.856 4.432     .  0 0 "[    .    1    .    2]" 1 
        881 1  43 MET QG   1  44 LEU H    . . 4.220 4.006 3.696 4.221 0.001  4 0 "[    .    1    .    2]" 1 
        882 1  43 MET QG   1  44 LEU HA   . . 4.730 4.271 3.870 4.724     .  0 0 "[    .    1    .    2]" 1 
        883 1  43 MET QG   1  45 LEU H    . . 5.500 4.638 4.095 5.406     .  0 0 "[    .    1    .    2]" 1 
        884 1  43 MET QG   1  45 LEU HB3  . . 4.380 4.080 3.659 4.382 0.002  8 0 "[    .    1    .    2]" 1 
        885 1  43 MET QG   1  45 LEU QD   . . 3.770 3.466 3.198 3.772 0.002  1 0 "[    .    1    .    2]" 1 
        886 1  43 MET QG   1  87 GLY H    . . 4.350 3.506 3.097 3.868     .  0 0 "[    .    1    .    2]" 1 
        887 1  43 MET QG   1  87 GLY HA2  . . 4.680 3.189 2.300 3.629     .  0 0 "[    .    1    .    2]" 1 
        888 1  43 MET QG   1  87 GLY HA3  . . 4.530 4.107 3.146 4.533 0.003 13 0 "[    .    1    .    2]" 1 
        889 1  44 LEU H    1  44 LEU HB2  . . 3.670 2.723 2.563 2.975     .  0 0 "[    .    1    .    2]" 1 
        890 1  44 LEU H    1  44 LEU QB   . . 3.200 2.387 2.321 2.545     .  0 0 "[    .    1    .    2]" 1 
        891 1  44 LEU H    1  44 LEU HB3  . . 3.670 2.651 2.518 2.776     .  0 0 "[    .    1    .    2]" 1 
        892 1  44 LEU H    1  44 LEU MD1  . . 4.560 4.213 4.045 4.431     .  0 0 "[    .    1    .    2]" 1 
        893 1  44 LEU H    1  44 LEU MD2  . . 4.700 4.367 4.265 4.508     .  0 0 "[    .    1    .    2]" 1 
        894 1  44 LEU H    1  44 LEU HG   . . 4.730 4.535 4.479 4.586     .  0 0 "[    .    1    .    2]" 1 
        895 1  44 LEU H    1  45 LEU H    . . 4.730 4.351 4.143 4.552     .  0 0 "[    .    1    .    2]" 1 
        896 1  44 LEU H    1  86 TRP HE3  . . 4.750 4.354 3.923 4.696     .  0 0 "[    .    1    .    2]" 1 
        897 1  44 LEU H    1  86 TRP HZ3  . . 4.670 3.230 2.735 3.796     .  0 0 "[    .    1    .    2]" 1 
        898 1  44 LEU HA   1  44 LEU MD1  . . 3.350 2.350 1.975 2.619     .  0 0 "[    .    1    .    2]" 1 
        899 1  44 LEU HA   1  44 LEU MD2  . . 4.310 3.883 3.845 3.919     .  0 0 "[    .    1    .    2]" 1 
        900 1  44 LEU HA   1  44 LEU HG   . . 4.080 2.788 2.635 3.051     .  0 0 "[    .    1    .    2]" 1 
        901 1  44 LEU HA   1  45 LEU H    . . 2.890 2.152 2.140 2.208     .  0 0 "[    .    1    .    2]" 1 
        902 1  44 LEU HA   1  45 LEU QD   . . 4.400 3.587 2.900 4.426 0.026  8 0 "[    .    1    .    2]" 1 
        903 1  44 LEU HA   1  86 TRP HA   . . 4.040 3.080 2.851 3.392     .  0 0 "[    .    1    .    2]" 1 
        904 1  44 LEU HA   1  86 TRP HE3  . . 3.830 2.446 2.153 2.762     .  0 0 "[    .    1    .    2]" 1 
        905 1  44 LEU HA   1  86 TRP HZ3  . . 4.580 3.358 3.001 3.687     .  0 0 "[    .    1    .    2]" 1 
        906 1  44 LEU HA   1  87 GLY H    . . 4.460 3.792 3.222 4.338     .  0 0 "[    .    1    .    2]" 1 
        907 1  44 LEU QB   1  44 LEU MD1  . . 3.150 2.119 1.987 2.294     .  0 0 "[    .    1    .    2]" 1 
        908 1  44 LEU QB   1  68 TYR QE   . . 4.690 3.259 2.985 3.622     .  0 0 "[    .    1    .    2]" 1 
        909 1  44 LEU QB   1  86 TRP HE3  . . 3.960 2.840 2.461 3.130     .  0 0 "[    .    1    .    2]" 1 
        910 1  44 LEU QB   1  86 TRP HZ3  . . 3.550 2.133 1.991 2.387     .  0 0 "[    .    1    .    2]" 1 
        911 1  44 LEU HB2  1  44 LEU MD2  . . 3.560 2.542 2.360 2.623     .  0 0 "[    .    1    .    2]" 1 
        912 1  44 LEU HB2  1  86 TRP HE3  . . 4.660 2.880 2.485 3.190     .  0 0 "[    .    1    .    2]" 1 
        913 1  44 LEU HB2  1  86 TRP HZ3  . . 4.250 2.145 2.002 2.403     .  0 0 "[    .    1    .    2]" 1 
        914 1  44 LEU HB3  1  44 LEU MD2  . . 3.560 2.197 2.016 2.342     .  0 0 "[    .    1    .    2]" 1 
        915 1  44 LEU HB3  1  86 TRP HE3  . . 4.660 4.353 3.980 4.542     .  0 0 "[    .    1    .    2]" 1 
        916 1  44 LEU HB3  1  86 TRP HZ3  . . 4.250 3.751 3.516 4.099     .  0 0 "[    .    1    .    2]" 1 
        917 1  44 LEU MD1  1  45 LEU H    . . 3.530 3.316 3.073 3.530     .  0 0 "[    .    1    .    2]" 1 
        918 1  44 LEU MD1  1  86 TRP H    . . 5.190 4.782 4.524 4.953     .  0 0 "[    .    1    .    2]" 1 
        919 1  44 LEU MD1  1  86 TRP HA   . . 4.090 2.901 2.498 3.267     .  0 0 "[    .    1    .    2]" 1 
        920 1  44 LEU MD1  1  86 TRP HB2  . . 4.730 2.877 2.406 3.316     .  0 0 "[    .    1    .    2]" 1 
        921 1  44 LEU MD1  1  86 TRP QB   . . 4.160 2.836 2.386 3.249     .  0 0 "[    .    1    .    2]" 1 
        922 1  44 LEU MD1  1  86 TRP HB3  . . 4.730 4.322 3.929 4.718     .  0 0 "[    .    1    .    2]" 1 
        923 1  44 LEU MD1  1  86 TRP HE3  . . 3.530 1.923 1.843 2.020     .  0 0 "[    .    1    .    2]" 1 
        924 1  44 LEU MD1  1  86 TRP HZ3  . . 3.920 2.886 2.620 3.161     .  0 0 "[    .    1    .    2]" 1 
        925 1  44 LEU MD2  1  45 LEU H    . . 5.070 4.540 3.944 4.906     .  0 0 "[    .    1    .    2]" 1 
        926 1  44 LEU MD2  1  60 MET ME   . . 4.100 3.838 3.166 4.098     .  0 0 "[    .    1    .    2]" 1 
        927 1  44 LEU MD2  1  68 TYR HB2  . . 4.090 1.943 1.826 2.053     .  0 0 "[    .    1    .    2]" 1 
        928 1  44 LEU MD2  1  68 TYR HB3  . . 3.850 2.297 2.055 2.551     .  0 0 "[    .    1    .    2]" 1 
        929 1  44 LEU MD2  1  68 TYR QD   . . 3.770 2.560 2.062 3.011     .  0 0 "[    .    1    .    2]" 1 
        930 1  44 LEU MD2  1  68 TYR QE   . . 4.320 3.886 3.482 4.312     .  0 0 "[    .    1    .    2]" 1 
        931 1  44 LEU MD2  1  86 TRP HE3  . . 4.730 4.235 4.094 4.441     .  0 0 "[    .    1    .    2]" 1 
        932 1  44 LEU MD2  1  86 TRP HZ3  . . 4.500 4.114 3.724 4.429     .  0 0 "[    .    1    .    2]" 1 
        933 1  44 LEU HG   1  45 LEU H    . . 3.570 3.053 2.334 3.568     .  0 0 "[    .    1    .    2]" 1 
        934 1  44 LEU HG   1  60 MET ME   . . 4.470 4.119 3.268 4.418     .  0 0 "[    .    1    .    2]" 1 
        935 1  44 LEU HG   1  86 TRP HE3  . . 4.750 4.027 3.670 4.532     .  0 0 "[    .    1    .    2]" 1 
        936 1  44 LEU HG   1  86 TRP HZ3  . . 4.880 4.861 4.785 4.881 0.001  8 0 "[    .    1    .    2]" 1 
        937 1  45 LEU H    1  45 LEU HB2  . . 4.000 3.818 3.733 3.919     .  0 0 "[    .    1    .    2]" 1 
        938 1  45 LEU H    1  45 LEU HB3  . . 3.670 2.956 2.823 3.192     .  0 0 "[    .    1    .    2]" 1 
        939 1  45 LEU H    1  45 LEU MD1  . . 4.200 2.532 1.725 3.773     .  0 0 "[    .    1    .    2]" 1 
        940 1  45 LEU H    1  45 LEU QD   . . 3.400 2.315 1.720 3.275     .  0 0 "[    .    1    .    2]" 1 
        941 1  45 LEU H    1  45 LEU MD2  . . 4.200 3.443 3.216 3.657     .  0 0 "[    .    1    .    2]" 1 
        942 1  45 LEU H    1  45 LEU HG   . . 4.030 3.296 2.236 4.035 0.005  1 0 "[    .    1    .    2]" 1 
        943 1  45 LEU H    1  46 ILE H    . . 4.800 4.471 4.412 4.524     .  0 0 "[    .    1    .    2]" 1 
        944 1  45 LEU H    1  60 MET ME   . . 5.500 4.349 3.995 4.573     .  0 0 "[    .    1    .    2]" 1 
        945 1  45 LEU H    1  86 TRP HA   . . 4.600 3.732 3.534 4.018     .  0 0 "[    .    1    .    2]" 1 
        946 1  45 LEU H    1  86 TRP HE3  . . 4.560 4.229 3.971 4.521     .  0 0 "[    .    1    .    2]" 1 
        947 1  45 LEU H    1  87 GLY H    . . 4.750 4.109 3.479 4.454     .  0 0 "[    .    1    .    2]" 1 
        948 1  45 LEU HA   1  45 LEU MD1  . . 4.200 3.492 3.383 3.603     .  0 0 "[    .    1    .    2]" 1 
        949 1  45 LEU HA   1  45 LEU QD   . . 3.440 3.164 3.030 3.377     .  0 0 "[    .    1    .    2]" 1 
        950 1  45 LEU HA   1  45 LEU MD2  . . 4.200 3.663 3.353 4.096     .  0 0 "[    .    1    .    2]" 1 
        951 1  45 LEU HA   1  46 ILE H    . . 2.880 2.416 2.309 2.491     .  0 0 "[    .    1    .    2]" 1 
        952 1  45 LEU HA   1  46 ILE HA   . . 4.660 4.444 4.412 4.477     .  0 0 "[    .    1    .    2]" 1 
        953 1  45 LEU HA   1  46 ILE HB   . . 4.850 4.685 4.592 4.846     .  0 0 "[    .    1    .    2]" 1 
        954 1  45 LEU HA   1  46 ILE MD   . . 4.520 4.154 3.831 4.472     .  0 0 "[    .    1    .    2]" 1 
        955 1  45 LEU HA   1  60 MET ME   . . 3.980 2.122 1.866 2.413     .  0 0 "[    .    1    .    2]" 1 
        956 1  45 LEU HB2  1  45 LEU MD1  . . 3.580 2.755 1.994 3.190     .  0 0 "[    .    1    .    2]" 1 
        957 1  45 LEU HB2  1  45 LEU QD   . . 2.880 2.088 1.939 2.160     .  0 0 "[    .    1    .    2]" 1 
        958 1  45 LEU HB2  1  45 LEU MD2  . . 3.580 2.361 2.088 2.717     .  0 0 "[    .    1    .    2]" 1 
        959 1  45 LEU HB2  1  46 ILE H    . . 3.720 2.479 2.334 2.710     .  0 0 "[    .    1    .    2]" 1 
        960 1  45 LEU HB3  1  45 LEU QD   . . 3.030 2.233 1.951 2.377     .  0 0 "[    .    1    .    2]" 1 
        961 1  45 LEU HB3  1  46 ILE H    . . 4.130 3.871 3.780 4.009     .  0 0 "[    .    1    .    2]" 1 
        962 1  45 LEU QD   1  46 ILE H    . . 3.840 2.449 2.209 2.825     .  0 0 "[    .    1    .    2]" 1 
        963 1  45 LEU QD   1  46 ILE HA   . . 3.980 2.752 2.569 3.154     .  0 0 "[    .    1    .    2]" 1 
        964 1  45 LEU QD   1  46 ILE MD   . . 4.560 3.773 3.432 4.354     .  0 0 "[    .    1    .    2]" 1 
        965 1  45 LEU QD   1  47 GLY H    . . 3.940 3.566 3.372 3.866     .  0 0 "[    .    1    .    2]" 1 
        966 1  45 LEU QD   1  47 GLY HA2  . . 4.150 3.881 3.728 4.045     .  0 0 "[    .    1    .    2]" 1 
        967 1  45 LEU QD   1  47 GLY HA3  . . 4.170 3.686 3.588 3.817     .  0 0 "[    .    1    .    2]" 1 
        968 1  45 LEU QD   1  60 MET ME   . . 4.390 3.975 3.609 4.310     .  0 0 "[    .    1    .    2]" 1 
        969 1  45 LEU QD   1  85 LYS H    . . 4.480 2.668 2.303 3.235     .  0 0 "[    .    1    .    2]" 1 
        970 1  45 LEU QD   1  85 LYS HB2  . . 4.170 1.920 1.712 2.236     .  0 0 "[    .    1    .    2]" 1 
        971 1  45 LEU QD   1  85 LYS HB3  . . 3.670 2.607 2.129 3.104     .  0 0 "[    .    1    .    2]" 1 
        972 1  45 LEU QD   1  85 LYS QD   . . 3.630 2.549 2.056 2.978     .  0 0 "[    .    1    .    2]" 1 
        973 1  45 LEU QD   1  85 LYS HE2  . . 3.760 3.497 3.210 3.707     .  0 0 "[    .    1    .    2]" 1 
        974 1  45 LEU QD   1  86 TRP HA   . . 4.420 3.759 3.166 4.424 0.004 13 0 "[    .    1    .    2]" 1 
        975 1  45 LEU QD   1  87 GLY H    . . 3.940 3.110 2.705 3.603     .  0 0 "[    .    1    .    2]" 1 
        976 1  45 LEU QD   1  87 GLY HA2  . . 4.610 4.016 3.580 4.318     .  0 0 "[    .    1    .    2]" 1 
        977 1  45 LEU QD   1  87 GLY HA3  . . 5.440 5.089 4.679 5.436     .  0 0 "[    .    1    .    2]" 1 
        978 1  45 LEU QD   1  88 GLU H    . . 4.270 3.507 3.109 3.712     .  0 0 "[    .    1    .    2]" 1 
        979 1  45 LEU QD   1  88 GLU HA   . . 4.850 4.601 4.002 4.852 0.002 12 0 "[    .    1    .    2]" 1 
        980 1  45 LEU MD1  1  46 ILE H    . . 4.770 3.520 2.641 4.176     .  0 0 "[    .    1    .    2]" 1 
        981 1  45 LEU MD1  1  46 ILE HA   . . 5.500 3.584 2.854 4.233     .  0 0 "[    .    1    .    2]" 1 
        982 1  45 LEU MD1  1  85 LYS H    . . 5.230 2.860 2.615 3.289     .  0 0 "[    .    1    .    2]" 1 
        983 1  45 LEU MD1  1  85 LYS HB2  . . 4.900 2.002 1.806 2.315     .  0 0 "[    .    1    .    2]" 1 
        984 1  45 LEU MD1  1  85 LYS HB3  . . 5.110 2.803 2.148 3.613     .  0 0 "[    .    1    .    2]" 1 
        985 1  45 LEU MD2  1  46 ILE H    . . 4.770 3.222 2.222 4.750     .  0 0 "[    .    1    .    2]" 1 
        986 1  45 LEU MD2  1  46 ILE HA   . . 5.500 3.779 2.599 5.515 0.015  8 0 "[    .    1    .    2]" 1 
        987 1  45 LEU MD2  1  85 LYS H    . . 5.230 3.522 2.557 4.818     .  0 0 "[    .    1    .    2]" 1 
        988 1  45 LEU MD2  1  85 LYS HB2  . . 4.900 2.578 2.077 3.253     .  0 0 "[    .    1    .    2]" 1 
        989 1  45 LEU MD2  1  85 LYS HB3  . . 5.110 3.533 3.130 3.881     .  0 0 "[    .    1    .    2]" 1 
        990 1  45 LEU HG   1  46 ILE H    . . 4.800 4.344 4.199 4.510     .  0 0 "[    .    1    .    2]" 1 
        991 1  45 LEU HG   1  46 ILE HA   . . 5.500 5.114 4.494 5.508 0.008 19 0 "[    .    1    .    2]" 1 
        992 1  45 LEU HG   1  85 LYS HB2  . . 4.130 3.263 2.284 3.980     .  0 0 "[    .    1    .    2]" 1 
        993 1  45 LEU HG   1  85 LYS HB3  . . 4.760 4.172 3.242 4.761 0.001 12 0 "[    .    1    .    2]" 1 
        994 1  46 ILE H    1  46 ILE HB   . . 3.560 2.762 2.674 2.931     .  0 0 "[    .    1    .    2]" 1 
        995 1  46 ILE H    1  46 ILE MD   . . 4.480 3.775 3.631 3.965     .  0 0 "[    .    1    .    2]" 1 
        996 1  46 ILE H    1  46 ILE HG12 . . 4.220 2.776 2.596 2.928     .  0 0 "[    .    1    .    2]" 1 
        997 1  46 ILE H    1  46 ILE QG   . . 3.560 2.734 2.563 2.877     .  0 0 "[    .    1    .    2]" 1 
        998 1  46 ILE H    1  46 ILE HG13 . . 4.220 4.106 3.871 4.220     .  0 0 "[    .    1    .    2]" 1 
        999 1  46 ILE H    1  46 ILE MG   . . 3.950 3.903 3.866 3.961 0.011  1 0 "[    .    1    .    2]" 1 
       1000 1  46 ILE H    1  47 GLY H    . . 4.630 4.447 4.416 4.483     .  0 0 "[    .    1    .    2]" 1 
       1001 1  46 ILE H    1  47 GLY HA2  . . 5.060 4.878 4.825 4.948     .  0 0 "[    .    1    .    2]" 1 
       1002 1  46 ILE H    1  60 MET ME   . . 3.860 2.627 2.275 3.025     .  0 0 "[    .    1    .    2]" 1 
       1003 1  46 ILE HA   1  46 ILE MD   . . 3.620 2.176 1.999 2.295     .  0 0 "[    .    1    .    2]" 1 
       1004 1  46 ILE HA   1  46 ILE MG   . . 3.400 2.284 2.116 2.376     .  0 0 "[    .    1    .    2]" 1 
       1005 1  46 ILE HA   1  47 GLY H    . . 2.880 2.269 2.218 2.324     .  0 0 "[    .    1    .    2]" 1 
       1006 1  46 ILE HA   1  48 VAL MG1  . . 5.500 4.975 4.771 5.173     .  0 0 "[    .    1    .    2]" 1 
       1007 1  46 ILE HA   1  82 LEU MD1  . . 5.500 4.774 4.467 4.997     .  0 0 "[    .    1    .    2]" 1 
       1008 1  46 ILE HA   1  83 ALA MB   . . 5.500 4.720 4.388 5.113     .  0 0 "[    .    1    .    2]" 1 
       1009 1  46 ILE HA   1  84 VAL HA   . . 3.870 2.846 2.614 3.098     .  0 0 "[    .    1    .    2]" 1 
       1010 1  46 ILE HA   1  84 VAL MG1  . . 4.390 3.787 3.425 4.277     .  0 0 "[    .    1    .    2]" 1 
       1011 1  46 ILE HA   1  84 VAL MG2  . . 4.430 3.908 3.555 4.314     .  0 0 "[    .    1    .    2]" 1 
       1012 1  46 ILE HA   1  85 LYS H    . . 4.250 3.283 3.050 3.482     .  0 0 "[    .    1    .    2]" 1 
       1013 1  46 ILE HB   1  46 ILE MD   . . 3.530 3.217 3.196 3.230     .  0 0 "[    .    1    .    2]" 1 
       1014 1  46 ILE HB   1  47 GLY H    . . 3.930 3.788 3.556 3.917     .  0 0 "[    .    1    .    2]" 1 
       1015 1  46 ILE HB   1  48 VAL MG1  . . 4.570 3.787 3.494 3.981     .  0 0 "[    .    1    .    2]" 1 
       1016 1  46 ILE HB   1  48 VAL MG2  . . 5.070 4.433 4.171 4.899     .  0 0 "[    .    1    .    2]" 1 
       1017 1  46 ILE HB   1  58 VAL MG1  . . 3.680 3.026 2.821 3.186     .  0 0 "[    .    1    .    2]" 1 
       1018 1  46 ILE HB   1  58 VAL MG2  . . 4.550 4.242 4.115 4.470     .  0 0 "[    .    1    .    2]" 1 
       1019 1  46 ILE HB   1  60 MET ME   . . 3.970 3.368 3.175 3.716     .  0 0 "[    .    1    .    2]" 1 
       1020 1  46 ILE HB   1  70 VAL MG1  . . 5.270 3.927 3.784 4.151     .  0 0 "[    .    1    .    2]" 1 
       1021 1  46 ILE HB   1  70 VAL MG2  . . 5.210 4.762 4.505 5.047     .  0 0 "[    .    1    .    2]" 1 
       1022 1  46 ILE MD   1  47 GLY H    . . 4.250 3.585 3.361 3.867     .  0 0 "[    .    1    .    2]" 1 
       1023 1  46 ILE MD   1  60 MET ME   . . 3.530 3.334 2.905 3.530     .  0 0 "[    .    1    .    2]" 1 
       1024 1  46 ILE MD   1  60 MET QG   . . 4.350 4.072 3.618 4.305     .  0 0 "[    .    1    .    2]" 1 
       1025 1  46 ILE MD   1  70 VAL MG1  . . 3.240 2.722 2.126 3.024     .  0 0 "[    .    1    .    2]" 1 
       1026 1  46 ILE MD   1  70 VAL MG2  . . 3.040 2.737 2.090 3.019     .  0 0 "[    .    1    .    2]" 1 
       1027 1  46 ILE MD   1  85 LYS H    . . 4.170 3.544 3.216 3.929     .  0 0 "[    .    1    .    2]" 1 
       1028 1  46 ILE QG   1  47 GLY H    . . 5.300 4.484 4.422 4.559     .  0 0 "[    .    1    .    2]" 1 
       1029 1  46 ILE QG   1  70 VAL MG2  . . 3.480 2.630 2.413 2.887     .  0 0 "[    .    1    .    2]" 1 
       1030 1  46 ILE HG12 1  46 ILE MG   . . 3.430 3.192 3.169 3.201     .  0 0 "[    .    1    .    2]" 1 
       1031 1  46 ILE HG12 1  58 VAL MG1  . . 4.170 4.139 4.061 4.172 0.002 18 0 "[    .    1    .    2]" 1 
       1032 1  46 ILE HG12 1  60 MET ME   . . 4.130 2.003 1.919 2.121     .  0 0 "[    .    1    .    2]" 1 
       1033 1  46 ILE HG12 1  60 MET QG   . . 4.520 3.490 3.272 3.694     .  0 0 "[    .    1    .    2]" 1 
       1034 1  46 ILE HG12 1  70 VAL MG1  . . 4.160 3.469 3.189 3.739     .  0 0 "[    .    1    .    2]" 1 
       1035 1  46 ILE HG12 1  70 VAL MG2  . . 4.170 3.267 3.043 3.477     .  0 0 "[    .    1    .    2]" 1 
       1036 1  46 ILE HG13 1  46 ILE MG   . . 3.430 2.388 2.252 2.586     .  0 0 "[    .    1    .    2]" 1 
       1037 1  46 ILE HG13 1  58 VAL MG1  . . 4.170 3.135 2.895 3.276     .  0 0 "[    .    1    .    2]" 1 
       1038 1  46 ILE HG13 1  60 MET ME   . . 4.130 3.006 2.718 3.300     .  0 0 "[    .    1    .    2]" 1 
       1039 1  46 ILE HG13 1  60 MET QG   . . 4.520 2.940 2.575 3.219     .  0 0 "[    .    1    .    2]" 1 
       1040 1  46 ILE HG13 1  70 VAL MG1  . . 4.160 2.079 1.966 2.296     .  0 0 "[    .    1    .    2]" 1 
       1041 1  46 ILE HG13 1  70 VAL MG2  . . 4.170 2.779 2.504 3.088     .  0 0 "[    .    1    .    2]" 1 
       1042 1  46 ILE MG   1  47 GLY H    . . 3.530 2.056 1.908 2.284     .  0 0 "[    .    1    .    2]" 1 
       1043 1  46 ILE MG   1  48 VAL H    . . 4.850 2.109 1.916 2.471     .  0 0 "[    .    1    .    2]" 1 
       1044 1  46 ILE MG   1  48 VAL HA   . . 4.250 3.495 3.382 3.617     .  0 0 "[    .    1    .    2]" 1 
       1045 1  46 ILE MG   1  48 VAL MG1  . . 3.110 2.060 1.898 2.242     .  0 0 "[    .    1    .    2]" 1 
       1046 1  46 ILE MG   1  48 VAL MG2  . . 3.560 3.264 2.906 3.552     .  0 0 "[    .    1    .    2]" 1 
       1047 1  46 ILE MG   1  60 MET ME   . . 4.310 4.266 4.153 4.311 0.001 14 0 "[    .    1    .    2]" 1 
       1048 1  46 ILE MG   1  60 MET QG   . . 4.640 4.407 4.159 4.624     .  0 0 "[    .    1    .    2]" 1 
       1049 1  46 ILE MG   1  70 VAL MG1  . . 3.830 3.106 2.809 3.391     .  0 0 "[    .    1    .    2]" 1 
       1050 1  46 ILE MG   1  82 LEU MD1  . . 3.220 2.610 2.425 2.808     .  0 0 "[    .    1    .    2]" 1 
       1051 1  46 ILE MG   1  82 LEU HG   . . 4.520 4.381 4.225 4.507     .  0 0 "[    .    1    .    2]" 1 
       1052 1  46 ILE MG   1  83 ALA H    . . 4.800 3.724 3.364 4.078     .  0 0 "[    .    1    .    2]" 1 
       1053 1  47 GLY H    1  48 VAL H    . . 4.600 2.990 2.878 3.181     .  0 0 "[    .    1    .    2]" 1 
       1054 1  47 GLY H    1  48 VAL HA   . . 4.490 4.270 4.199 4.338     .  0 0 "[    .    1    .    2]" 1 
       1055 1  47 GLY H    1  48 VAL MG1  . . 4.050 4.013 3.889 4.055 0.005 19 0 "[    .    1    .    2]" 1 
       1056 1  47 GLY H    1  82 LEU MD1  . . 4.420 4.284 3.979 4.420     .  0 0 "[    .    1    .    2]" 1 
       1057 1  47 GLY H    1  83 ALA H    . . 4.200 4.040 3.860 4.170     .  0 0 "[    .    1    .    2]" 1 
       1058 1  47 GLY H    1  83 ALA MB   . . 3.720 3.071 2.658 3.461     .  0 0 "[    .    1    .    2]" 1 
       1059 1  47 GLY H    1  85 LYS HB2  . . 5.500 5.472 5.349 5.506 0.006  4 0 "[    .    1    .    2]" 1 
       1060 1  47 GLY HA2  1  48 VAL H    . . 3.250 2.644 2.540 2.696     .  0 0 "[    .    1    .    2]" 1 
       1061 1  47 GLY HA2  1  48 VAL HA   . . 4.740 4.727 4.659 4.758 0.018 19 0 "[    .    1    .    2]" 1 
       1062 1  47 GLY HA2  1  48 VAL MG1  . . 4.780 4.546 4.323 4.691     .  0 0 "[    .    1    .    2]" 1 
       1063 1  47 GLY HA2  1  83 ALA MB   . . 4.440 4.317 4.092 4.439     .  0 0 "[    .    1    .    2]" 1 
       1064 1  47 GLY HA3  1  83 ALA MB   . . 4.600 3.073 2.823 3.298     .  0 0 "[    .    1    .    2]" 1 
       1065 1  48 VAL H    1  48 VAL HB   . . 3.790 3.622 3.607 3.634     .  0 0 "[    .    1    .    2]" 1 
       1066 1  48 VAL H    1  48 VAL MG1  . . 3.740 2.266 2.007 2.461     .  0 0 "[    .    1    .    2]" 1 
       1067 1  48 VAL H    1  48 VAL MG2  . . 4.290 2.135 1.909 2.379     .  0 0 "[    .    1    .    2]" 1 
       1068 1  48 VAL H    1  49 HIS H    . . 4.940 4.480 4.203 4.634     .  0 0 "[    .    1    .    2]" 1 
       1069 1  48 VAL H    1  58 VAL MG2  . . 4.530 4.110 3.976 4.264     .  0 0 "[    .    1    .    2]" 1 
       1070 1  48 VAL H    1  83 ALA H    . . 5.010 4.701 4.526 4.959     .  0 0 "[    .    1    .    2]" 1 
       1071 1  48 VAL H    1  83 ALA MB   . . 5.010 4.389 3.971 4.591     .  0 0 "[    .    1    .    2]" 1 
       1072 1  48 VAL HA   1  48 VAL MG1  . . 3.250 2.253 2.138 2.335     .  0 0 "[    .    1    .    2]" 1 
       1073 1  48 VAL HA   1  48 VAL MG2  . . 3.280 3.187 3.174 3.202     .  0 0 "[    .    1    .    2]" 1 
       1074 1  48 VAL HA   1  49 HIS H    . . 2.930 2.176 2.141 2.253     .  0 0 "[    .    1    .    2]" 1 
       1075 1  48 VAL HA   1  83 ALA H    . . 4.540 3.114 2.780 3.398     .  0 0 "[    .    1    .    2]" 1 
       1076 1  48 VAL HB   1  55 CYS QB   . . 3.790 3.494 2.921 3.772     .  0 0 "[    .    1    .    2]" 1 
       1077 1  48 VAL HB   1  58 VAL MG2  . . 4.220 3.992 3.621 4.199     .  0 0 "[    .    1    .    2]" 1 
       1078 1  48 VAL MG1  1  55 CYS QB   . . 4.010 3.390 2.902 3.647     .  0 0 "[    .    1    .    2]" 1 
       1079 1  48 VAL MG1  1  58 VAL MG1  . . 3.210 3.035 2.705 3.187     .  0 0 "[    .    1    .    2]" 1 
       1080 1  48 VAL MG1  1  58 VAL MG2  . . 3.140 2.169 1.979 2.434     .  0 0 "[    .    1    .    2]" 1 
       1081 1  48 VAL MG1  1  72 TYR HB2  . . 4.280 4.131 3.999 4.278     .  0 0 "[    .    1    .    2]" 1 
       1082 1  48 VAL MG1  1  72 TYR HB3  . . 3.850 3.805 3.659 3.851 0.001  7 0 "[    .    1    .    2]" 1 
       1083 1  48 VAL MG2  1  49 HIS H    . . 4.230 4.072 3.633 4.255 0.025 19 0 "[    .    1    .    2]" 1 
       1084 1  48 VAL MG2  1  55 CYS QB   . . 3.760 3.343 2.815 3.734     .  0 0 "[    .    1    .    2]" 1 
       1085 1  48 VAL MG2  1  58 VAL HB   . . 5.160 4.241 3.805 4.803     .  0 0 "[    .    1    .    2]" 1 
       1086 1  49 HIS H    1  49 HIS HB2  . . 3.910 2.806 2.177 3.619     .  0 0 "[    .    1    .    2]" 1 
       1087 1  49 HIS H    1  49 HIS QB   . . 3.390 2.345 2.148 2.626     .  0 0 "[    .    1    .    2]" 1 
       1088 1  49 HIS H    1  49 HIS HB3  . . 3.910 2.802 2.466 3.490     .  0 0 "[    .    1    .    2]" 1 
       1089 1  49 HIS H    1  50 GLY H    . . 5.020 4.600 4.528 4.647     .  0 0 "[    .    1    .    2]" 1 
       1090 1  49 HIS H    1  81 VAL HB   . . 4.660 4.406 4.071 4.662 0.002 13 0 "[    .    1    .    2]" 1 
       1091 1  49 HIS HA   1  49 HIS HD2  . . 4.910 4.094 3.273 4.739     .  0 0 "[    .    1    .    2]" 1 
       1092 1  49 HIS HA   1  50 GLY H    . . 2.940 2.280 2.216 2.387     .  0 0 "[    .    1    .    2]" 1 
       1093 1  49 HIS HA   1  50 GLY QA   . . 4.860 3.898 3.888 3.918     .  0 0 "[    .    1    .    2]" 1 
       1094 1  49 HIS HA   1  51 PRO HD2  . . 4.870 4.849 4.789 4.872 0.002 12 0 "[    .    1    .    2]" 1 
       1095 1  49 HIS QB   1  50 GLY H    . . 3.960 3.081 2.464 3.504     .  0 0 "[    .    1    .    2]" 1 
       1096 1  49 HIS QB   1  51 PRO HA   . . 5.340 5.271 5.097 5.358 0.018 12 0 "[    .    1    .    2]" 1 
       1097 1  49 HIS QB   1  51 PRO HD2  . . 3.580 3.418 3.165 3.523     .  0 0 "[    .    1    .    2]" 1 
       1098 1  49 HIS QB   1  51 PRO HD3  . . 3.770 2.143 1.990 2.256     .  0 0 "[    .    1    .    2]" 1 
       1099 1  49 HIS QB   1  51 PRO QG   . . 3.850 3.387 3.170 3.633     .  0 0 "[    .    1    .    2]" 1 
       1100 1  49 HIS QB   1  81 VAL HB   . . 4.180 2.864 2.386 3.403     .  0 0 "[    .    1    .    2]" 1 
       1101 1  49 HIS QB   1  81 VAL MG1  . . 4.140 3.198 2.750 3.838     .  0 0 "[    .    1    .    2]" 1 
       1102 1  49 HIS HB2  1  50 GLY H    . . 4.670 3.652 2.495 4.264     .  0 0 "[    .    1    .    2]" 1 
       1103 1  49 HIS HB2  1  81 VAL MG1  . . 4.810 3.908 3.041 4.807     .  0 0 "[    .    1    .    2]" 1 
       1104 1  49 HIS HB3  1  50 GLY H    . . 4.670 3.667 2.994 3.935     .  0 0 "[    .    1    .    2]" 1 
       1105 1  49 HIS HB3  1  81 VAL MG1  . . 4.810 3.509 3.099 4.266     .  0 0 "[    .    1    .    2]" 1 
       1106 1  49 HIS HD2  1  50 GLY H    . . 4.070 3.404 2.036 4.074 0.004  7 0 "[    .    1    .    2]" 1 
       1107 1  49 HIS HD2  1  51 PRO HA   . . 5.500 4.247 3.024 5.506 0.006 10 0 "[    .    1    .    2]" 1 
       1108 1  49 HIS HD2  1  51 PRO QG   . . 4.460 3.167 2.261 4.430     .  0 0 "[    .    1    .    2]" 1 
       1109 1  50 GLY H    1  51 PRO HD2  . . 4.380 3.649 3.205 3.925     .  0 0 "[    .    1    .    2]" 1 
       1110 1  50 GLY H    1  51 PRO HD3  . . 4.730 2.800 2.230 3.176     .  0 0 "[    .    1    .    2]" 1 
       1111 1  50 GLY QA   1  51 PRO HD3  . . 3.460 3.029 2.982 3.109     .  0 0 "[    .    1    .    2]" 1 
       1112 1  50 GLY QA   1  52 THR H    . . 4.620 3.462 3.084 3.792     .  0 0 "[    .    1    .    2]" 1 
       1113 1  51 PRO HA   1  52 THR HA   . . 4.650 4.554 4.525 4.578     .  0 0 "[    .    1    .    2]" 1 
       1114 1  51 PRO QB   1  52 THR H    . . 3.500 3.070 2.801 3.404     .  0 0 "[    .    1    .    2]" 1 
       1115 1  51 PRO QB   1  52 THR MG   . . 3.940 3.077 2.507 3.911     .  0 0 "[    .    1    .    2]" 1 
       1116 1  51 PRO QB   1  53 THR H    . . 5.340 4.930 4.527 5.232     .  0 0 "[    .    1    .    2]" 1 
       1117 1  51 PRO HD2  1  52 THR H    . . 4.380 2.691 2.647 2.767     .  0 0 "[    .    1    .    2]" 1 
       1118 1  51 PRO QG   1  52 THR H    . . 4.560 2.200 1.891 2.659     .  0 0 "[    .    1    .    2]" 1 
       1119 1  51 PRO QG   1  53 THR H    . . 5.350 3.717 3.126 4.088     .  0 0 "[    .    1    .    2]" 1 
       1120 1  52 THR H    1  52 THR HB   . . 4.110 3.579 3.029 3.827     .  0 0 "[    .    1    .    2]" 1 
       1121 1  52 THR H    1  52 THR MG   . . 3.880 2.637 1.889 3.188     .  0 0 "[    .    1    .    2]" 1 
       1122 1  52 THR H    1  53 THR H    . . 3.020 2.172 1.898 2.411     .  0 0 "[    .    1    .    2]" 1 
       1123 1  52 THR HA   1  52 THR MG   . . 3.280 2.581 2.111 3.202     .  0 0 "[    .    1    .    2]" 1 
       1124 1  52 THR HB   1  53 THR H    . . 3.780 3.512 3.058 3.787 0.007  7 0 "[    .    1    .    2]" 1 
       1125 1  52 THR MG   1  53 THR H    . . 4.680 3.131 1.759 4.062     .  0 0 "[    .    1    .    2]" 1 
       1126 1  53 THR H    1  53 THR HB   . . 4.020 3.250 2.627 3.883     .  0 0 "[    .    1    .    2]" 1 
       1127 1  53 THR H    1  53 THR MG   . . 4.000 3.647 2.751 4.015 0.015  8 0 "[    .    1    .    2]" 1 
       1128 1  53 THR H    1  54 PRO QD   . . 4.230 3.889 3.491 4.251 0.021 18 0 "[    .    1    .    2]" 1 
       1129 1  53 THR HA   1  53 THR MG   . . 3.000 2.312 2.111 2.476     .  0 0 "[    .    1    .    2]" 1 
       1130 1  53 THR HA   1  54 PRO HD2  . . 3.440 2.037 1.915 2.236     .  0 0 "[    .    1    .    2]" 1 
       1131 1  53 THR HA   1  54 PRO HD3  . . 3.440 2.418 2.255 2.672     .  0 0 "[    .    1    .    2]" 1 
       1132 1  53 THR HA   1  54 PRO HG2  . . 4.420 4.216 4.116 4.381     .  0 0 "[    .    1    .    2]" 1 
       1133 1  53 THR HA   1  54 PRO HG3  . . 4.420 4.389 4.319 4.485 0.065  5 0 "[    .    1    .    2]" 1 
       1134 1  53 THR HB   1  54 PRO QD   . . 4.450 3.699 2.433 4.347     .  0 0 "[    .    1    .    2]" 1 
       1135 1  53 THR HB   1  76 GLU QB   . . 3.800 3.098 2.071 3.801 0.001 19 0 "[    .    1    .    2]" 1 
       1136 1  53 THR MG   1  54 PRO QD   . . 3.640 2.702 1.807 3.597     .  0 0 "[    .    1    .    2]" 1 
       1137 1  53 THR MG   1  76 GLU QB   . . 4.420 2.545 1.819 3.800     .  0 0 "[    .    1    .    2]" 1 
       1138 1  53 THR MG   1  76 GLU QG   . . 4.310 3.505 2.286 4.225     .  0 0 "[    .    1    .    2]" 1 
       1139 1  54 PRO HA   1  55 CYS H    . . 3.190 2.436 2.235 2.684     .  0 0 "[    .    1    .    2]" 1 
       1140 1  54 PRO QB   1  55 CYS H    . . 3.750 2.476 1.961 2.956     .  0 0 "[    .    1    .    2]" 1 
       1141 1  54 PRO HB2  1  55 CYS H    . . 4.290 2.547 1.980 3.101     .  0 0 "[    .    1    .    2]" 1 
       1142 1  54 PRO HB3  1  55 CYS H    . . 4.290 3.431 3.174 3.725     .  0 0 "[    .    1    .    2]" 1 
       1143 1  55 CYS H    1  55 CYS QB   . . 3.360 2.433 2.209 2.722     .  0 0 "[    .    1    .    2]" 1 
       1144 1  55 CYS H    1  56 GLU H    . . 5.020 4.589 4.546 4.624     .  0 0 "[    .    1    .    2]" 1 
       1145 1  55 CYS H    1  57 GLU H    . . 5.500 5.496 5.445 5.524 0.024 18 0 "[    .    1    .    2]" 1 
       1146 1  55 CYS H    1  74 VAL MG1  . . 5.300 5.110 4.813 5.300     .  0 0 "[    .    1    .    2]" 1 
       1147 1  55 CYS HA   1  56 GLU H    . . 3.070 2.309 2.289 2.316     .  0 0 "[    .    1    .    2]" 1 
       1148 1  55 CYS HA   1  56 GLU QB   . . 4.830 4.395 4.126 4.568     .  0 0 "[    .    1    .    2]" 1 
       1149 1  55 CYS HA   1  57 GLU H    . . 4.390 4.336 4.255 4.402 0.012 18 0 "[    .    1    .    2]" 1 
       1150 1  55 CYS HA   1  74 VAL HA   . . 4.090 3.180 2.779 3.568     .  0 0 "[    .    1    .    2]" 1 
       1151 1  55 CYS HA   1  74 VAL MG1  . . 4.070 3.230 2.900 3.664     .  0 0 "[    .    1    .    2]" 1 
       1152 1  55 CYS QB   1  56 GLU H    . . 3.770 2.878 2.619 3.331     .  0 0 "[    .    1    .    2]" 1 
       1153 1  55 CYS QB   1  57 GLU H    . . 3.700 3.017 2.686 3.236     .  0 0 "[    .    1    .    2]" 1 
       1154 1  55 CYS QB   1  58 VAL MG2  . . 3.660 3.186 2.699 3.530     .  0 0 "[    .    1    .    2]" 1 
       1155 1  55 CYS QB   1  72 TYR HB2  . . 4.730 3.092 2.560 3.725     .  0 0 "[    .    1    .    2]" 1 
       1156 1  55 CYS QB   1  72 TYR QD   . . 4.640 4.160 3.514 4.643 0.003 18 0 "[    .    1    .    2]" 1 
       1157 1  55 CYS QB   1  73 VAL H    . . 4.670 3.458 2.793 4.318     .  0 0 "[    .    1    .    2]" 1 
       1158 1  55 CYS QB   1  74 VAL MG1  . . 3.920 3.389 2.995 3.783     .  0 0 "[    .    1    .    2]" 1 
       1159 1  55 CYS QB   1  80 TYR QD   . . 5.500 5.080 4.432 5.498     .  0 0 "[    .    1    .    2]" 1 
       1160 1  55 CYS QB   1  80 TYR QE   . . 5.240 4.383 3.832 4.944     .  0 0 "[    .    1    .    2]" 1 
       1161 1  56 GLU H    1  56 GLU HB2  . . 3.670 2.301 2.192 2.469     .  0 0 "[    .    1    .    2]" 1 
       1162 1  56 GLU H    1  56 GLU QB   . . 3.070 2.267 2.133 2.428     .  0 0 "[    .    1    .    2]" 1 
       1163 1  56 GLU H    1  56 GLU HB3  . . 3.670 3.456 2.919 3.588     .  0 0 "[    .    1    .    2]" 1 
       1164 1  56 GLU H    1  56 GLU HG2  . . 4.320 2.988 2.329 4.415 0.095 18 0 "[    .    1    .    2]" 1 
       1165 1  56 GLU H    1  56 GLU QG   . . 3.790 2.779 2.304 3.797 0.007 18 0 "[    .    1    .    2]" 1 
       1166 1  56 GLU H    1  56 GLU HG3  . . 4.320 3.719 2.792 4.380 0.060 17 0 "[    .    1    .    2]" 1 
       1167 1  56 GLU H    1  57 GLU H    . . 3.130 2.691 2.645 2.722     .  0 0 "[    .    1    .    2]" 1 
       1168 1  56 GLU H    1  73 VAL H    . . 5.050 3.624 3.446 3.860     .  0 0 "[    .    1    .    2]" 1 
       1169 1  56 GLU H    1  73 VAL HB   . . 4.750 3.778 3.481 3.960     .  0 0 "[    .    1    .    2]" 1 
       1170 1  56 GLU H    1  73 VAL MG1  . . 4.610 4.079 3.833 4.542     .  0 0 "[    .    1    .    2]" 1 
       1171 1  56 GLU H    1  73 VAL MG2  . . 5.240 5.097 4.866 5.219     .  0 0 "[    .    1    .    2]" 1 
       1172 1  56 GLU H    1  74 VAL H    . . 5.500 5.020 4.831 5.367     .  0 0 "[    .    1    .    2]" 1 
       1173 1  56 GLU H    1  74 VAL MG1  . . 5.140 4.121 3.606 4.767     .  0 0 "[    .    1    .    2]" 1 
       1174 1  56 GLU HA   1  56 GLU HG2  . . 3.910 2.715 2.165 3.704     .  0 0 "[    .    1    .    2]" 1 
       1175 1  56 GLU HA   1  56 GLU HG3  . . 3.910 3.495 2.494 3.728     .  0 0 "[    .    1    .    2]" 1 
       1176 1  56 GLU HA   1  57 GLU HA   . . 4.830 4.656 4.627 4.673     .  0 0 "[    .    1    .    2]" 1 
       1177 1  56 GLU QB   1  57 GLU H    . . 3.040 2.573 2.471 2.685     .  0 0 "[    .    1    .    2]" 1 
       1178 1  56 GLU QB   1  73 VAL HB   . . 3.780 2.127 1.977 2.358     .  0 0 "[    .    1    .    2]" 1 
       1179 1  56 GLU QB   1  73 VAL MG1  . . 3.660 2.803 2.253 3.153     .  0 0 "[    .    1    .    2]" 1 
       1180 1  56 GLU HB2  1  73 VAL MG1  . . 4.190 2.900 2.347 3.261     .  0 0 "[    .    1    .    2]" 1 
       1181 1  56 GLU HB3  1  73 VAL MG1  . . 4.190 3.736 2.904 4.190     .  0 0 "[    .    1    .    2]" 1 
       1182 1  56 GLU QG   1  57 GLU H    . . 4.410 4.251 4.079 4.420 0.010 15 0 "[    .    1    .    2]" 1 
       1183 1  56 GLU QG   1  75 LYS QE   . . 4.980 3.303 1.804 4.979     .  0 0 "[    .    1    .    2]" 1 
       1184 1  56 GLU HG2  1  57 GLU H    . . 5.050 4.633 4.318 4.959     .  0 0 "[    .    1    .    2]" 1 
       1185 1  56 GLU HG2  1  73 VAL MG1  . . 4.210 3.556 2.513 4.212 0.002 18 0 "[    .    1    .    2]" 1 
       1186 1  56 GLU HG2  1  75 LYS QD   . . 4.230 3.734 2.007 4.211     .  0 0 "[    .    1    .    2]" 1 
       1187 1  56 GLU HG3  1  57 GLU H    . . 5.050 4.978 4.653 5.082 0.032 18 0 "[    .    1    .    2]" 1 
       1188 1  56 GLU HG3  1  73 VAL MG1  . . 4.210 2.757 2.063 3.982     .  0 0 "[    .    1    .    2]" 1 
       1189 1  56 GLU HG3  1  75 LYS QD   . . 4.230 3.121 2.074 4.136     .  0 0 "[    .    1    .    2]" 1 
       1190 1  57 GLU H    1  57 GLU QG   . . 4.290 2.899 2.607 3.989     .  0 0 "[    .    1    .    2]" 1 
       1191 1  57 GLU H    1  58 VAL H    . . 4.370 4.359 4.347 4.367     .  0 0 "[    .    1    .    2]" 1 
       1192 1  57 GLU H    1  58 VAL MG2  . . 4.480 3.768 3.614 3.874     .  0 0 "[    .    1    .    2]" 1 
       1193 1  57 GLU H    1  72 TYR HA   . . 4.870 4.195 4.005 4.416     .  0 0 "[    .    1    .    2]" 1 
       1194 1  57 GLU H    1  73 VAL H    . . 3.490 2.953 2.756 3.270     .  0 0 "[    .    1    .    2]" 1 
       1195 1  57 GLU H    1  73 VAL HB   . . 3.800 3.649 3.469 3.798     .  0 0 "[    .    1    .    2]" 1 
       1196 1  57 GLU H    1  73 VAL MG2  . . 4.540 4.460 3.983 4.540     .  0 0 "[    .    1    .    2]" 1 
       1197 1  57 GLU HA   1  57 GLU QG   . . 3.520 3.329 2.707 3.507     .  0 0 "[    .    1    .    2]" 1 
       1198 1  57 GLU HA   1  58 VAL H    . . 2.750 2.508 2.435 2.570     .  0 0 "[    .    1    .    2]" 1 
       1199 1  57 GLU HA   1  58 VAL MG2  . . 4.250 3.320 3.152 3.446     .  0 0 "[    .    1    .    2]" 1 
       1200 1  57 GLU QB   1  58 VAL H    . . 3.170 2.304 2.142 3.221 0.051 19 0 "[    .    1    .    2]" 1 
       1201 1  57 GLU HB2  1  58 VAL H    . . 3.740 2.336 2.157 3.487     .  0 0 "[    .    1    .    2]" 1 
       1202 1  57 GLU HB3  1  58 VAL H    . . 3.740 3.720 3.648 3.786 0.046 19 0 "[    .    1    .    2]" 1 
       1203 1  57 GLU QG   1  58 VAL H    . . 3.400 3.097 1.800 3.400     .  0 0 "[    .    1    .    2]" 1 
       1204 1  57 GLU QG   1  58 VAL HA   . . 4.960 3.583 3.080 3.858     .  0 0 "[    .    1    .    2]" 1 
       1205 1  57 GLU QG   1  59 SER H    . . 4.010 3.680 3.222 4.013 0.003 16 0 "[    .    1    .    2]" 1 
       1206 1  57 GLU QG   1  59 SER HA   . . 5.400 4.933 4.054 5.290     .  0 0 "[    .    1    .    2]" 1 
       1207 1  57 GLU QG   1  59 SER QB   . . 4.110 3.809 3.427 4.108     .  0 0 "[    .    1    .    2]" 1 
       1208 1  57 GLU QG   1  72 TYR HA   . . 4.560 3.511 3.183 3.804     .  0 0 "[    .    1    .    2]" 1 
       1209 1  57 GLU QG   1  73 VAL MG2  . . 3.900 3.321 2.996 3.832     .  0 0 "[    .    1    .    2]" 1 
       1210 1  58 VAL H    1  58 VAL HB   . . 3.590 2.848 2.776 2.930     .  0 0 "[    .    1    .    2]" 1 
       1211 1  58 VAL H    1  58 VAL MG1  . . 4.000 3.932 3.904 3.967     .  0 0 "[    .    1    .    2]" 1 
       1212 1  58 VAL H    1  58 VAL MG2  . . 3.820 2.968 2.867 3.117     .  0 0 "[    .    1    .    2]" 1 
       1213 1  58 VAL H    1  59 SER H    . . 4.570 3.932 3.860 4.081     .  0 0 "[    .    1    .    2]" 1 
       1214 1  58 VAL H    1  59 SER HA   . . 4.820 4.545 4.476 4.612     .  0 0 "[    .    1    .    2]" 1 
       1215 1  58 VAL HA   1  58 VAL MG1  . . 3.410 2.298 2.230 2.394     .  0 0 "[    .    1    .    2]" 1 
       1216 1  58 VAL HA   1  58 VAL MG2  . . 3.490 2.368 2.265 2.459     .  0 0 "[    .    1    .    2]" 1 
       1217 1  58 VAL HA   1  59 SER H    . . 2.820 2.167 2.140 2.193     .  0 0 "[    .    1    .    2]" 1 
       1218 1  58 VAL HA   1  72 TYR H    . . 5.140 5.020 4.779 5.139     .  0 0 "[    .    1    .    2]" 1 
       1219 1  58 VAL HA   1  72 TYR HA   . . 3.670 2.854 2.476 3.004     .  0 0 "[    .    1    .    2]" 1 
       1220 1  58 VAL HA   1  72 TYR HB2  . . 4.570 3.867 3.603 4.079     .  0 0 "[    .    1    .    2]" 1 
       1221 1  58 VAL HA   1  72 TYR HB3  . . 4.200 2.989 2.752 3.196     .  0 0 "[    .    1    .    2]" 1 
       1222 1  58 VAL HA   1  73 VAL H    . . 4.860 4.657 4.342 4.822     .  0 0 "[    .    1    .    2]" 1 
       1223 1  58 VAL HB   1  59 SER H    . . 4.710 4.369 4.290 4.423     .  0 0 "[    .    1    .    2]" 1 
       1224 1  58 VAL HB   1  59 SER HA   . . 5.500 4.932 4.852 4.999     .  0 0 "[    .    1    .    2]" 1 
       1225 1  58 VAL HB   1  60 MET H    . . 5.500 5.250 5.058 5.501 0.001  9 0 "[    .    1    .    2]" 1 
       1226 1  58 VAL HB   1  60 MET QG   . . 4.010 3.797 3.600 4.012 0.002 18 0 "[    .    1    .    2]" 1 
       1227 1  58 VAL HB   1  70 VAL MG1  . . 5.500 4.725 4.510 4.930     .  0 0 "[    .    1    .    2]" 1 
       1228 1  58 VAL MG1  1  59 SER H    . . 3.450 3.020 2.797 3.266     .  0 0 "[    .    1    .    2]" 1 
       1229 1  58 VAL MG1  1  60 MET H    . . 4.090 3.940 3.681 4.056     .  0 0 "[    .    1    .    2]" 1 
       1230 1  58 VAL MG1  1  60 MET HB2  . . 4.480 4.221 4.025 4.419     .  0 0 "[    .    1    .    2]" 1 
       1231 1  58 VAL MG1  1  60 MET HB3  . . 4.590 4.455 4.276 4.578     .  0 0 "[    .    1    .    2]" 1 
       1232 1  58 VAL MG1  1  60 MET QG   . . 3.320 2.011 1.919 2.204     .  0 0 "[    .    1    .    2]" 1 
       1233 1  58 VAL MG1  1  70 VAL MG1  . . 2.980 2.267 2.048 2.386     .  0 0 "[    .    1    .    2]" 1 
       1234 1  58 VAL MG1  1  71 THR H    . . 4.200 3.792 3.403 4.113     .  0 0 "[    .    1    .    2]" 1 
       1235 1  58 VAL MG1  1  72 TYR HA   . . 4.370 4.247 3.942 4.384 0.014 18 0 "[    .    1    .    2]" 1 
       1236 1  58 VAL MG1  1  72 TYR HB2  . . 4.660 4.490 4.077 4.654     .  0 0 "[    .    1    .    2]" 1 
       1237 1  58 VAL MG1  1  72 TYR HB3  . . 3.810 3.218 2.882 3.426     .  0 0 "[    .    1    .    2]" 1 
       1238 1  58 VAL MG2  1  59 SER H    . . 4.260 4.197 4.035 4.244     .  0 0 "[    .    1    .    2]" 1 
       1239 1  58 VAL MG2  1  60 MET QG   . . 4.490 4.441 4.329 4.498 0.008 18 0 "[    .    1    .    2]" 1 
       1240 1  58 VAL MG2  1  72 TYR HA   . . 4.240 3.819 3.410 4.011     .  0 0 "[    .    1    .    2]" 1 
       1241 1  58 VAL MG2  1  72 TYR HB2  . . 3.690 3.230 2.752 3.578     .  0 0 "[    .    1    .    2]" 1 
       1242 1  58 VAL MG2  1  72 TYR HB3  . . 3.300 2.827 2.153 3.152     .  0 0 "[    .    1    .    2]" 1 
       1243 1  58 VAL MG2  1  73 VAL H    . . 4.510 4.372 3.909 4.511 0.001 18 0 "[    .    1    .    2]" 1 
       1244 1  59 SER H    1  59 SER QB   . . 3.310 2.333 2.181 2.715     .  0 0 "[    .    1    .    2]" 1 
       1245 1  59 SER H    1  60 MET H    . . 4.530 4.299 4.223 4.380     .  0 0 "[    .    1    .    2]" 1 
       1246 1  59 SER H    1  70 VAL MG1  . . 4.330 4.042 3.783 4.218     .  0 0 "[    .    1    .    2]" 1 
       1247 1  59 SER H    1  71 THR H    . . 3.540 3.199 2.816 3.409     .  0 0 "[    .    1    .    2]" 1 
       1248 1  59 SER H    1  71 THR HB   . . 4.620 3.852 3.640 4.164     .  0 0 "[    .    1    .    2]" 1 
       1249 1  59 SER H    1  72 TYR HA   . . 3.670 3.446 3.204 3.670     .  0 0 "[    .    1    .    2]" 1 
       1250 1  59 SER H    1  72 TYR HB2  . . 5.500 5.368 5.169 5.503 0.003 14 0 "[    .    1    .    2]" 1 
       1251 1  59 SER H    1  72 TYR HB3  . . 4.600 4.340 4.133 4.540     .  0 0 "[    .    1    .    2]" 1 
       1252 1  59 SER HA   1  60 MET H    . . 2.780 2.154 2.142 2.171     .  0 0 "[    .    1    .    2]" 1 
       1253 1  59 SER HA   1  60 MET HB2  . . 5.500 4.772 4.649 4.852     .  0 0 "[    .    1    .    2]" 1 
       1254 1  59 SER QB   1  60 MET H    . . 3.950 3.840 3.567 3.951 0.001  6 0 "[    .    1    .    2]" 1 
       1255 1  59 SER QB   1  71 THR H    . . 4.230 3.074 2.814 4.052     .  0 0 "[    .    1    .    2]" 1 
       1256 1  60 MET H    1  60 MET HB2  . . 3.390 2.682 2.572 2.747     .  0 0 "[    .    1    .    2]" 1 
       1257 1  60 MET H    1  60 MET HB3  . . 3.820 3.761 3.719 3.802     .  0 0 "[    .    1    .    2]" 1 
       1258 1  60 MET H    1  60 MET ME   . . 4.850 4.668 4.475 4.850     .  0 0 "[    .    1    .    2]" 1 
       1259 1  60 MET H    1  60 MET QG   . . 3.810 2.562 2.395 2.778     .  0 0 "[    .    1    .    2]" 1 
       1260 1  60 MET H    1  61 LYS H    . . 4.400 4.345 4.281 4.415 0.015 18 0 "[    .    1    .    2]" 1 
       1261 1  60 MET H    1  70 VAL HA   . . 4.960 4.742 4.658 4.833     .  0 0 "[    .    1    .    2]" 1 
       1262 1  60 MET HA   1  60 MET ME   . . 4.120 4.082 3.896 4.121 0.001  9 0 "[    .    1    .    2]" 1 
       1263 1  60 MET HA   1  60 MET QG   . . 3.600 2.578 2.478 2.631     .  0 0 "[    .    1    .    2]" 1 
       1264 1  60 MET HA   1  61 LYS H    . . 2.720 2.146 2.140 2.166     .  0 0 "[    .    1    .    2]" 1 
       1265 1  60 MET HA   1  61 LYS HB2  . . 4.490 4.267 4.205 4.330     .  0 0 "[    .    1    .    2]" 1 
       1266 1  60 MET HA   1  70 VAL HA   . . 3.470 2.437 2.278 2.590     .  0 0 "[    .    1    .    2]" 1 
       1267 1  60 MET HA   1  70 VAL MG1  . . 4.180 3.406 3.204 3.600     .  0 0 "[    .    1    .    2]" 1 
       1268 1  60 MET HA   1  70 VAL MG2  . . 3.770 2.649 2.405 3.085     .  0 0 "[    .    1    .    2]" 1 
       1269 1  60 MET HA   1  71 THR H    . . 4.130 3.821 3.638 3.995     .  0 0 "[    .    1    .    2]" 1 
       1270 1  60 MET HB2  1  61 LYS H    . . 4.220 4.158 4.044 4.219     .  0 0 "[    .    1    .    2]" 1 
       1271 1  60 MET HB2  1  70 VAL MG1  . . 4.900 4.629 4.439 4.771     .  0 0 "[    .    1    .    2]" 1 
       1272 1  60 MET HB2  1  70 VAL MG2  . . 4.260 4.077 3.743 4.264 0.004 18 0 "[    .    1    .    2]" 1 
       1273 1  60 MET HB3  1  60 MET ME   . . 3.300 2.071 1.979 2.238     .  0 0 "[    .    1    .    2]" 1 
       1274 1  60 MET HB3  1  61 LYS H    . . 3.750 3.380 3.194 3.503     .  0 0 "[    .    1    .    2]" 1 
       1275 1  60 MET HB3  1  70 VAL MG1  . . 4.610 3.945 3.722 4.214     .  0 0 "[    .    1    .    2]" 1 
       1276 1  60 MET HB3  1  70 VAL MG2  . . 3.750 2.745 2.373 3.065     .  0 0 "[    .    1    .    2]" 1 
       1277 1  60 MET ME   1  60 MET QG   . . 3.110 2.513 2.449 2.610     .  0 0 "[    .    1    .    2]" 1 
       1278 1  60 MET ME   1  70 VAL MG1  . . 4.040 3.693 3.436 3.924     .  0 0 "[    .    1    .    2]" 1 
       1279 1  60 MET ME   1  70 VAL MG2  . . 3.680 2.952 2.249 3.277     .  0 0 "[    .    1    .    2]" 1 
       1280 1  60 MET QG   1  61 LYS H    . . 4.380 4.311 4.135 4.385 0.005 14 0 "[    .    1    .    2]" 1 
       1281 1  60 MET QG   1  70 VAL HA   . . 4.500 3.236 2.968 3.445     .  0 0 "[    .    1    .    2]" 1 
       1282 1  60 MET QG   1  70 VAL MG1  . . 4.150 2.108 1.966 2.316     .  0 0 "[    .    1    .    2]" 1 
       1283 1  60 MET QG   1  70 VAL MG2  . . 3.460 2.208 2.010 2.450     .  0 0 "[    .    1    .    2]" 1 
       1284 1  60 MET QG   1  71 THR H    . . 4.840 4.095 3.768 4.346     .  0 0 "[    .    1    .    2]" 1 
       1285 1  61 LYS H    1  61 LYS HB2  . . 3.440 2.682 2.560 2.953     .  0 0 "[    .    1    .    2]" 1 
       1286 1  61 LYS H    1  61 LYS HD2  . . 5.500 5.119 3.768 5.473     .  0 0 "[    .    1    .    2]" 1 
       1287 1  61 LYS H    1  61 LYS HD3  . . 5.500 4.888 3.038 5.502 0.002 17 0 "[    .    1    .    2]" 1 
       1288 1  61 LYS H    1  61 LYS HG2  . . 4.920 4.038 3.623 4.832     .  0 0 "[    .    1    .    2]" 1 
       1289 1  61 LYS H    1  61 LYS HG3  . . 4.920 4.528 3.877 4.926 0.006 11 0 "[    .    1    .    2]" 1 
       1290 1  61 LYS H    1  63 VAL MG1  . . 5.500 5.183 4.862 5.405     .  0 0 "[    .    1    .    2]" 1 
       1291 1  61 LYS H    1  68 TYR HA   . . 5.310 4.630 4.302 4.890     .  0 0 "[    .    1    .    2]" 1 
       1292 1  61 LYS H    1  69 ASN H    . . 3.600 3.315 3.046 3.564     .  0 0 "[    .    1    .    2]" 1 
       1293 1  61 LYS H    1  69 ASN HB2  . . 4.840 4.468 4.271 4.718     .  0 0 "[    .    1    .    2]" 1 
       1294 1  61 LYS H    1  69 ASN HB3  . . 4.320 3.259 3.074 3.496     .  0 0 "[    .    1    .    2]" 1 
       1295 1  61 LYS H    1  70 VAL HA   . . 4.150 3.698 3.395 3.935     .  0 0 "[    .    1    .    2]" 1 
       1296 1  61 LYS H    1  70 VAL MG2  . . 4.000 3.406 3.073 3.772     .  0 0 "[    .    1    .    2]" 1 
       1297 1  61 LYS HA   1  61 LYS HD2  . . 4.710 3.218 1.999 4.663     .  0 0 "[    .    1    .    2]" 1 
       1298 1  61 LYS HA   1  61 LYS QD   . . 4.040 2.546 1.981 3.833     .  0 0 "[    .    1    .    2]" 1 
       1299 1  61 LYS HA   1  61 LYS HD3  . . 4.710 2.930 2.093 4.530     .  0 0 "[    .    1    .    2]" 1 
       1300 1  61 LYS HA   1  61 LYS HG2  . . 3.950 2.680 2.176 3.548     .  0 0 "[    .    1    .    2]" 1 
       1301 1  61 LYS HA   1  61 LYS QG   . . 3.450 2.399 2.155 2.620     .  0 0 "[    .    1    .    2]" 1 
       1302 1  61 LYS HA   1  61 LYS HG3  . . 3.950 3.314 2.181 3.656     .  0 0 "[    .    1    .    2]" 1 
       1303 1  61 LYS HA   1  62 HIS H    . . 2.950 2.251 2.177 2.340     .  0 0 "[    .    1    .    2]" 1 
       1304 1  61 LYS HA   1  62 HIS HB2  . . 4.860 4.586 4.511 4.658     .  0 0 "[    .    1    .    2]" 1 
       1305 1  61 LYS HA   1  62 HIS QB   . . 4.210 4.046 4.011 4.069     .  0 0 "[    .    1    .    2]" 1 
       1306 1  61 LYS HA   1  62 HIS HB3  . . 4.860 4.502 4.446 4.590     .  0 0 "[    .    1    .    2]" 1 
       1307 1  61 LYS HB2  1  61 LYS QD   . . 3.670 3.061 2.074 3.402     .  0 0 "[    .    1    .    2]" 1 
       1308 1  61 LYS HB2  1  69 ASN H    . . 4.780 4.355 4.171 4.626     .  0 0 "[    .    1    .    2]" 1 
       1309 1  61 LYS HB2  1  69 ASN HB2  . . 4.650 4.358 4.173 4.651 0.001 11 0 "[    .    1    .    2]" 1 
       1310 1  61 LYS HB2  1  69 ASN HB3  . . 4.150 3.096 2.918 3.375     .  0 0 "[    .    1    .    2]" 1 
       1311 1  61 LYS HB3  1  61 LYS HD2  . . 4.150 2.697 2.105 4.212 0.062 15 0 "[    .    1    .    2]" 1 
       1312 1  61 LYS HB3  1  61 LYS QD   . . 3.610 2.440 2.071 3.398     .  0 0 "[    .    1    .    2]" 1 
       1313 1  61 LYS HB3  1  61 LYS HD3  . . 4.150 3.155 2.132 3.699     .  0 0 "[    .    1    .    2]" 1 
       1314 1  61 LYS HB3  1  61 LYS QE   . . 4.500 3.733 2.351 4.395     .  0 0 "[    .    1    .    2]" 1 
       1315 1  61 LYS HB3  1  62 HIS H    . . 3.720 3.019 2.668 3.559     .  0 0 "[    .    1    .    2]" 1 
       1316 1  61 LYS HB3  1  69 ASN H    . . 5.010 4.459 3.343 4.720     .  0 0 "[    .    1    .    2]" 1 
       1317 1  61 LYS HB3  1  69 ASN HB2  . . 4.910 4.648 3.276 4.904     .  0 0 "[    .    1    .    2]" 1 
       1318 1  61 LYS HB3  1  69 ASN HB3  . . 4.180 3.958 2.556 4.180     .  0 0 "[    .    1    .    2]" 1 
       1319 1  61 LYS HD2  1  62 HIS H    . . 5.500 3.826 2.590 5.522 0.022 14 0 "[    .    1    .    2]" 1 
       1320 1  61 LYS HD3  1  62 HIS H    . . 5.500 3.839 2.115 5.501 0.001  9 0 "[    .    1    .    2]" 1 
       1321 1  61 LYS QE   1  61 LYS HG2  . . 3.870 2.633 2.072 3.418     .  0 0 "[    .    1    .    2]" 1 
       1322 1  61 LYS QE   1  61 LYS QG   . . 3.370 2.194 2.047 2.373     .  0 0 "[    .    1    .    2]" 1 
       1323 1  61 LYS QE   1  61 LYS HG3  . . 3.870 2.526 2.069 3.259     .  0 0 "[    .    1    .    2]" 1 
       1324 1  61 LYS QG   1  62 HIS H    . . 4.690 3.819 2.372 4.316     .  0 0 "[    .    1    .    2]" 1 
       1325 1  61 LYS HG2  1  62 HIS H    . . 5.440 4.198 2.555 4.656     .  0 0 "[    .    1    .    2]" 1 
       1326 1  61 LYS HG3  1  62 HIS H    . . 5.440 4.580 2.811 5.155     .  0 0 "[    .    1    .    2]" 1 
       1327 1  62 HIS H    1  62 HIS HB2  . . 3.410 2.957 2.801 3.113     .  0 0 "[    .    1    .    2]" 1 
       1328 1  62 HIS H    1  62 HIS QB   . . 2.990 2.303 2.243 2.370     .  0 0 "[    .    1    .    2]" 1 
       1329 1  62 HIS H    1  62 HIS HB3  . . 3.410 2.404 2.348 2.465     .  0 0 "[    .    1    .    2]" 1 
       1330 1  62 HIS H    1  63 VAL H    . . 4.670 3.823 3.506 4.003     .  0 0 "[    .    1    .    2]" 1 
       1331 1  62 HIS H    1  63 VAL MG1  . . 5.500 5.027 4.826 5.172     .  0 0 "[    .    1    .    2]" 1 
       1332 1  62 HIS H    1  68 TYR HA   . . 5.500 4.893 4.762 5.036     .  0 0 "[    .    1    .    2]" 1 
       1333 1  62 HIS H    1  68 TYR QD   . . 4.570 4.430 4.137 4.571 0.001 11 0 "[    .    1    .    2]" 1 
       1334 1  62 HIS H    1  68 TYR QE   . . 5.200 5.093 4.805 5.197     .  0 0 "[    .    1    .    2]" 1 
       1335 1  62 HIS HA   1  62 HIS HD2  . . 4.670 2.821 2.670 3.130     .  0 0 "[    .    1    .    2]" 1 
       1336 1  62 HIS HA   1  63 VAL H    . . 2.930 2.351 2.282 2.492     .  0 0 "[    .    1    .    2]" 1 
       1337 1  62 HIS HA   1  63 VAL MG2  . . 3.980 3.486 3.415 3.591     .  0 0 "[    .    1    .    2]" 1 
       1338 1  62 HIS HA   1  68 TYR HA   . . 3.870 2.330 2.185 2.514     .  0 0 "[    .    1    .    2]" 1 
       1339 1  62 HIS HA   1  68 TYR QD   . . 4.150 3.076 2.903 3.268     .  0 0 "[    .    1    .    2]" 1 
       1340 1  62 HIS HA   1  68 TYR QE   . . 4.730 4.140 3.929 4.335     .  0 0 "[    .    1    .    2]" 1 
       1341 1  62 HIS HA   1  69 ASN H    . . 4.160 3.224 3.005 3.521     .  0 0 "[    .    1    .    2]" 1 
       1342 1  62 HIS QB   1  63 VAL H    . . 4.190 4.053 4.038 4.062     .  0 0 "[    .    1    .    2]" 1 
       1343 1  62 HIS QB   1  68 TYR HA   . . 5.270 4.007 3.911 4.246     .  0 0 "[    .    1    .    2]" 1 
       1344 1  62 HIS QB   1  68 TYR QD   . . 4.370 2.825 2.541 3.141     .  0 0 "[    .    1    .    2]" 1 
       1345 1  62 HIS QB   1  68 TYR QE   . . 3.580 2.471 2.310 2.635     .  0 0 "[    .    1    .    2]" 1 
       1346 1  62 HIS HB2  1  68 TYR QE   . . 4.240 2.492 2.329 2.663     .  0 0 "[    .    1    .    2]" 1 
       1347 1  62 HIS HB3  1  68 TYR QE   . . 4.240 4.055 3.801 4.229     .  0 0 "[    .    1    .    2]" 1 
       1348 1  62 HIS HD2  1  63 VAL H    . . 4.920 4.338 3.949 4.883     .  0 0 "[    .    1    .    2]" 1 
       1349 1  62 HIS HD2  1  63 VAL MG2  . . 4.770 4.075 3.858 4.487     .  0 0 "[    .    1    .    2]" 1 
       1350 1  62 HIS HD2  1  64 GLY H    . . 4.680 3.051 2.696 3.619     .  0 0 "[    .    1    .    2]" 1 
       1351 1  62 HIS HD2  1  66 GLN HA   . . 4.300 3.934 3.505 4.282     .  0 0 "[    .    1    .    2]" 1 
       1352 1  62 HIS HD2  1  67 GLN H    . . 3.450 3.234 2.898 3.448     .  0 0 "[    .    1    .    2]" 1 
       1353 1  62 HIS HD2  1  68 TYR HA   . . 5.480 3.490 3.052 4.122     .  0 0 "[    .    1    .    2]" 1 
       1354 1  62 HIS HD2  1  68 TYR QE   . . 4.790 3.502 3.203 3.899     .  0 0 "[    .    1    .    2]" 1 
       1355 1  62 HIS HE1  1  64 GLY H    . . 4.780 4.603 4.336 4.780 0.000 11 0 "[    .    1    .    2]" 1 
       1356 1  62 HIS HE1  1  64 GLY HA2  . . 4.390 2.714 2.506 2.864     .  0 0 "[    .    1    .    2]" 1 
       1357 1  62 HIS HE1  1  64 GLY QA   . . 3.800 2.681 2.483 2.826     .  0 0 "[    .    1    .    2]" 1 
       1358 1  62 HIS HE1  1  64 GLY HA3  . . 4.390 4.179 3.959 4.368     .  0 0 "[    .    1    .    2]" 1 
       1359 1  62 HIS HE1  1  65 ASN H    . . 4.640 4.237 3.982 4.484     .  0 0 "[    .    1    .    2]" 1 
       1360 1  62 HIS HE1  1  66 GLN H    . . 4.940 4.062 3.447 4.521     .  0 0 "[    .    1    .    2]" 1 
       1361 1  63 VAL H    1  63 VAL MG1  . . 3.640 2.520 2.318 2.712     .  0 0 "[    .    1    .    2]" 1 
       1362 1  63 VAL H    1  63 VAL MG2  . . 3.130 2.034 1.904 2.179     .  0 0 "[    .    1    .    2]" 1 
       1363 1  63 VAL H    1  64 GLY H    . . 3.110 2.832 2.749 2.948     .  0 0 "[    .    1    .    2]" 1 
       1364 1  63 VAL H    1  68 TYR HA   . . 3.870 3.210 2.888 3.406     .  0 0 "[    .    1    .    2]" 1 
       1365 1  63 VAL H    1  68 TYR QD   . . 5.240 5.050 4.904 5.178     .  0 0 "[    .    1    .    2]" 1 
       1366 1  63 VAL H    1  69 ASN H    . . 4.140 2.842 2.531 3.003     .  0 0 "[    .    1    .    2]" 1 
       1367 1  63 VAL HA   1  63 VAL MG1  . . 3.010 2.154 2.031 2.281     .  0 0 "[    .    1    .    2]" 1 
       1368 1  63 VAL HA   1  63 VAL MG2  . . 3.450 3.171 3.147 3.185     .  0 0 "[    .    1    .    2]" 1 
       1369 1  63 VAL HB   1  64 GLY H    . . 4.530 3.744 3.475 3.912     .  0 0 "[    .    1    .    2]" 1 
       1370 1  63 VAL MG1  1  64 GLY H    . . 4.300 4.205 4.103 4.288     .  0 0 "[    .    1    .    2]" 1 
       1371 1  63 VAL MG1  1  69 ASN H    . . 4.430 3.578 3.179 3.894     .  0 0 "[    .    1    .    2]" 1 
       1372 1  63 VAL MG1  1  69 ASN HB2  . . 3.310 2.248 1.957 2.487     .  0 0 "[    .    1    .    2]" 1 
       1373 1  63 VAL MG1  1  69 ASN HB3  . . 3.500 3.244 2.909 3.501 0.001 11 0 "[    .    1    .    2]" 1 
       1374 1  63 VAL MG1  1  69 ASN HD21 . . 5.340 5.129 4.725 5.329     .  0 0 "[    .    1    .    2]" 1 
       1375 1  63 VAL MG2  1  64 GLY H    . . 3.450 2.206 1.952 2.491     .  0 0 "[    .    1    .    2]" 1 
       1376 1  63 VAL MG2  1  67 GLN H    . . 4.260 3.449 3.336 3.616     .  0 0 "[    .    1    .    2]" 1 
       1377 1  63 VAL MG2  1  67 GLN HB2  . . 3.170 1.991 1.846 2.090     .  0 0 "[    .    1    .    2]" 1 
       1378 1  63 VAL MG2  1  67 GLN HB3  . . 3.410 2.641 2.191 2.922     .  0 0 "[    .    1    .    2]" 1 
       1379 1  63 VAL MG2  1  67 GLN HG2  . . 4.430 4.317 3.984 4.427     .  0 0 "[    .    1    .    2]" 1 
       1380 1  63 VAL MG2  1  67 GLN HG3  . . 4.520 4.043 3.812 4.256     .  0 0 "[    .    1    .    2]" 1 
       1381 1  63 VAL MG2  1  68 TYR H    . . 4.760 3.933 3.674 4.238     .  0 0 "[    .    1    .    2]" 1 
       1382 1  63 VAL MG2  1  68 TYR HA   . . 4.250 3.256 3.003 3.487     .  0 0 "[    .    1    .    2]" 1 
       1383 1  63 VAL MG2  1  69 ASN H    . . 3.880 2.848 2.625 3.076     .  0 0 "[    .    1    .    2]" 1 
       1384 1  63 VAL MG2  1  69 ASN HA   . . 4.540 4.077 3.844 4.293     .  0 0 "[    .    1    .    2]" 1 
       1385 1  63 VAL MG2  1  69 ASN HB2  . . 3.550 2.565 2.332 2.742     .  0 0 "[    .    1    .    2]" 1 
       1386 1  63 VAL MG2  1  69 ASN HB3  . . 4.240 3.993 3.769 4.218     .  0 0 "[    .    1    .    2]" 1 
       1387 1  64 GLY H    1  67 GLN H    . . 3.600 3.276 3.063 3.439     .  0 0 "[    .    1    .    2]" 1 
       1388 1  64 GLY H    1  67 GLN HB2  . . 4.370 3.507 3.138 3.821     .  0 0 "[    .    1    .    2]" 1 
       1389 1  65 ASN H    1  66 GLN H    . . 4.600 2.770 2.652 2.878     .  0 0 "[    .    1    .    2]" 1 
       1390 1  65 ASN H    1  67 GLN H    . . 4.750 4.185 4.076 4.300     .  0 0 "[    .    1    .    2]" 1 
       1391 1  65 ASN HA   1  67 GLN H    . . 4.730 4.497 4.330 4.642     .  0 0 "[    .    1    .    2]" 1 
       1392 1  65 ASN QB   1  65 ASN QD   . . 3.010 2.205 2.063 2.509     .  0 0 "[    .    1    .    2]" 1 
       1393 1  65 ASN QB   1  67 GLN H    . . 4.170 3.705 3.536 3.955     .  0 0 "[    .    1    .    2]" 1 
       1394 1  65 ASN QB   1  67 GLN HB2  . . 4.440 3.627 3.512 3.777     .  0 0 "[    .    1    .    2]" 1 
       1395 1  65 ASN HB2  1  67 GLN H    . . 4.880 4.194 3.879 4.804     .  0 0 "[    .    1    .    2]" 1 
       1396 1  65 ASN HB2  1  67 GLN HG2  . . 5.500 5.007 4.639 5.501 0.001 13 0 "[    .    1    .    2]" 1 
       1397 1  65 ASN HB2  1  67 GLN HG3  . . 4.470 3.458 3.073 4.244     .  0 0 "[    .    1    .    2]" 1 
       1398 1  65 ASN HB3  1  67 GLN H    . . 4.880 4.304 3.647 4.863     .  0 0 "[    .    1    .    2]" 1 
       1399 1  65 ASN HB3  1  67 GLN HG2  . . 5.500 4.413 3.670 4.896     .  0 0 "[    .    1    .    2]" 1 
       1400 1  65 ASN HB3  1  67 GLN HG3  . . 4.470 2.908 2.115 3.345     .  0 0 "[    .    1    .    2]" 1 
       1401 1  66 GLN H    1  66 GLN HG2  . . 5.010 3.497 2.653 4.448     .  0 0 "[    .    1    .    2]" 1 
       1402 1  66 GLN H    1  66 GLN QG   . . 4.290 2.925 2.628 3.180     .  0 0 "[    .    1    .    2]" 1 
       1403 1  66 GLN H    1  66 GLN HG3  . . 5.010 3.869 3.006 4.460     .  0 0 "[    .    1    .    2]" 1 
       1404 1  66 GLN H    1  67 GLN H    . . 3.210 2.587 2.503 2.674     .  0 0 "[    .    1    .    2]" 1 
       1405 1  66 GLN HA   1  66 GLN QE   . . 4.820 3.888 2.923 4.634     .  0 0 "[    .    1    .    2]" 1 
       1406 1  66 GLN HA   1  66 GLN HG2  . . 4.160 3.376 2.983 3.718     .  0 0 "[    .    1    .    2]" 1 
       1407 1  66 GLN HA   1  66 GLN QG   . . 3.650 2.810 2.428 3.226     .  0 0 "[    .    1    .    2]" 1 
       1408 1  66 GLN HA   1  66 GLN HG3  . . 4.160 3.314 2.467 3.914     .  0 0 "[    .    1    .    2]" 1 
       1409 1  66 GLN HA   1  67 GLN H    . . 3.430 2.945 2.850 2.985     .  0 0 "[    .    1    .    2]" 1 
       1410 1  66 GLN HA   1  68 TYR QE   . . 4.110 3.816 3.311 4.062     .  0 0 "[    .    1    .    2]" 1 
       1411 1  66 GLN HB3  1  68 TYR QE   . . 4.760 4.653 4.489 4.761 0.001 18 0 "[    .    1    .    2]" 1 
       1412 1  67 GLN H    1  67 GLN HB2  . . 3.060 2.625 2.555 2.711     .  0 0 "[    .    1    .    2]" 1 
       1413 1  67 GLN H    1  67 GLN HB3  . . 3.900 3.751 3.718 3.792     .  0 0 "[    .    1    .    2]" 1 
       1414 1  67 GLN H    1  67 GLN HG2  . . 4.140 3.942 3.670 4.102     .  0 0 "[    .    1    .    2]" 1 
       1415 1  67 GLN H    1  67 GLN HG3  . . 3.470 2.775 2.470 2.995     .  0 0 "[    .    1    .    2]" 1 
       1416 1  67 GLN H    1  68 TYR H    . . 4.590 4.418 4.358 4.516     .  0 0 "[    .    1    .    2]" 1 
       1417 1  67 GLN HA   1  67 GLN HG2  . . 3.590 2.645 2.510 2.895     .  0 0 "[    .    1    .    2]" 1 
       1418 1  67 GLN HA   1  67 GLN HG3  . . 3.950 3.052 2.859 3.248     .  0 0 "[    .    1    .    2]" 1 
       1419 1  67 GLN HA   1  68 TYR H    . . 2.890 2.190 2.142 2.407     .  0 0 "[    .    1    .    2]" 1 
       1420 1  67 GLN HA   1  68 TYR QD   . . 4.150 3.599 3.231 3.930     .  0 0 "[    .    1    .    2]" 1 
       1421 1  67 GLN HB2  1  68 TYR H    . . 4.800 4.055 3.502 4.223     .  0 0 "[    .    1    .    2]" 1 
       1422 1  67 GLN HB2  1  68 TYR HA   . . 4.880 4.753 4.471 4.859     .  0 0 "[    .    1    .    2]" 1 
       1423 1  67 GLN HB2  1  69 ASN H    . . 5.500 5.451 5.297 5.502 0.002 18 0 "[    .    1    .    2]" 1 
       1424 1  67 GLN HB3  1  68 TYR H    . . 4.070 3.109 2.449 3.416     .  0 0 "[    .    1    .    2]" 1 
       1425 1  68 TYR H    1  68 TYR HB2  . . 3.530 2.548 2.456 2.731     .  0 0 "[    .    1    .    2]" 1 
       1426 1  68 TYR H    1  68 TYR HB3  . . 3.890 3.721 3.667 3.815     .  0 0 "[    .    1    .    2]" 1 
       1427 1  68 TYR H    1  68 TYR QD   . . 3.430 2.956 2.743 3.313     .  0 0 "[    .    1    .    2]" 1 
       1428 1  68 TYR H    1  69 ASN H    . . 5.260 4.222 4.087 4.308     .  0 0 "[    .    1    .    2]" 1 
       1429 1  68 TYR HA   1  68 TYR QD   . . 3.660 2.910 2.720 3.033     .  0 0 "[    .    1    .    2]" 1 
       1430 1  68 TYR HA   1  68 TYR QE   . . 4.720 4.593 4.526 4.671     .  0 0 "[    .    1    .    2]" 1 
       1431 1  68 TYR HA   1  69 ASN H    . . 2.810 2.140 2.138 2.144     .  0 0 "[    .    1    .    2]" 1 
       1432 1  68 TYR HA   1  69 ASN HA   . . 4.620 4.397 4.386 4.405     .  0 0 "[    .    1    .    2]" 1 
       1433 1  68 TYR HA   1  69 ASN HB2  . . 4.360 4.320 4.300 4.347     .  0 0 "[    .    1    .    2]" 1 
       1434 1  68 TYR HA   1  69 ASN HB3  . . 5.020 4.962 4.920 4.984     .  0 0 "[    .    1    .    2]" 1 
       1435 1  68 TYR HB2  1  69 ASN H    . . 4.510 4.397 4.338 4.445     .  0 0 "[    .    1    .    2]" 1 
       1436 1  68 TYR HB2  1  70 VAL MG2  . . 4.210 3.736 3.627 3.877     .  0 0 "[    .    1    .    2]" 1 
       1437 1  68 TYR HB3  1  69 ASN H    . . 3.670 3.565 3.460 3.635     .  0 0 "[    .    1    .    2]" 1 
       1438 1  68 TYR HB3  1  70 VAL MG2  . . 4.600 3.039 2.860 3.175     .  0 0 "[    .    1    .    2]" 1 
       1439 1  68 TYR QD   1  69 ASN H    . . 4.470 4.249 4.118 4.390     .  0 0 "[    .    1    .    2]" 1 
       1440 1  69 ASN H    1  69 ASN HB2  . . 3.200 2.412 2.389 2.446     .  0 0 "[    .    1    .    2]" 1 
       1441 1  69 ASN H    1  69 ASN HB3  . . 3.270 2.824 2.783 2.845     .  0 0 "[    .    1    .    2]" 1 
       1442 1  69 ASN H    1  70 VAL H    . . 4.530 4.432 4.367 4.503     .  0 0 "[    .    1    .    2]" 1 
       1443 1  69 ASN HA   1  69 ASN HD21 . . 4.350 2.290 2.063 2.616     .  0 0 "[    .    1    .    2]" 1 
       1444 1  69 ASN HA   1  69 ASN HD22 . . 4.720 3.439 3.341 3.590     .  0 0 "[    .    1    .    2]" 1 
       1445 1  69 ASN HA   1  70 VAL H    . . 2.780 2.143 2.139 2.155     .  0 0 "[    .    1    .    2]" 1 
       1446 1  69 ASN HA   1  70 VAL HB   . . 4.690 4.661 4.607 4.691 0.001 16 0 "[    .    1    .    2]" 1 
       1447 1  69 ASN HA   1  70 VAL MG2  . . 4.090 3.740 3.560 3.863     .  0 0 "[    .    1    .    2]" 1 
       1448 1  69 ASN HB2  1  70 VAL H    . . 4.630 4.472 4.389 4.532     .  0 0 "[    .    1    .    2]" 1 
       1449 1  69 ASN HB3  1  70 VAL H    . . 4.460 4.052 3.923 4.148     .  0 0 "[    .    1    .    2]" 1 
       1450 1  69 ASN HD21 1  70 VAL H    . . 4.820 2.053 1.800 2.370     .  0 0 "[    .    1    .    2]" 1 
       1451 1  69 ASN HD21 1  70 VAL MG1  . . 5.160 4.941 4.828 5.071     .  0 0 "[    .    1    .    2]" 1 
       1452 1  69 ASN HD21 1  71 THR MG   . . 4.940 4.793 4.639 4.925     .  0 0 "[    .    1    .    2]" 1 
       1453 1  69 ASN HD22 1  70 VAL H    . . 5.220 3.509 3.224 3.771     .  0 0 "[    .    1    .    2]" 1 
       1454 1  69 ASN HD22 1  71 THR MG   . . 4.620 4.330 4.124 4.488     .  0 0 "[    .    1    .    2]" 1 
       1455 1  70 VAL H    1  70 VAL HB   . . 3.270 2.733 2.668 2.837     .  0 0 "[    .    1    .    2]" 1 
       1456 1  70 VAL H    1  70 VAL MG1  . . 4.040 3.890 3.861 3.935     .  0 0 "[    .    1    .    2]" 1 
       1457 1  70 VAL H    1  70 VAL MG2  . . 3.470 2.869 2.698 2.960     .  0 0 "[    .    1    .    2]" 1 
       1458 1  70 VAL H    1  71 THR H    . . 4.480 4.212 4.071 4.335     .  0 0 "[    .    1    .    2]" 1 
       1459 1  70 VAL H    1  71 THR MG   . . 5.500 5.496 5.434 5.511 0.011 19 0 "[    .    1    .    2]" 1 
       1460 1  70 VAL HA   1  70 VAL MG1  . . 3.360 2.326 2.251 2.373     .  0 0 "[    .    1    .    2]" 1 
       1461 1  70 VAL HA   1  70 VAL MG2  . . 3.240 2.348 2.283 2.481     .  0 0 "[    .    1    .    2]" 1 
       1462 1  70 VAL HA   1  71 THR H    . . 2.840 2.145 2.139 2.167     .  0 0 "[    .    1    .    2]" 1 
       1463 1  70 VAL HA   1  71 THR HA   . . 4.930 4.398 4.394 4.415     .  0 0 "[    .    1    .    2]" 1 
       1464 1  70 VAL HB   1  71 THR H    . . 4.570 4.249 4.066 4.373     .  0 0 "[    .    1    .    2]" 1 
       1465 1  70 VAL MG1  1  71 THR H    . . 3.310 2.785 2.494 3.132     .  0 0 "[    .    1    .    2]" 1 
       1466 1  70 VAL MG1  1  71 THR HA   . . 4.340 3.644 3.459 3.768     .  0 0 "[    .    1    .    2]" 1 
       1467 1  70 VAL MG1  1  72 TYR HB2  . . 5.480 5.413 5.314 5.481 0.001  1 0 "[    .    1    .    2]" 1 
       1468 1  70 VAL MG1  1  72 TYR QD   . . 3.510 3.143 2.939 3.328     .  0 0 "[    .    1    .    2]" 1 
       1469 1  70 VAL MG1  1  72 TYR QE   . . 4.840 4.403 4.143 4.695     .  0 0 "[    .    1    .    2]" 1 
       1470 1  70 VAL MG2  1  71 THR H    . . 4.270 4.104 4.026 4.177     .  0 0 "[    .    1    .    2]" 1 
       1471 1  71 THR H    1  71 THR HB   . . 3.370 2.992 2.925 3.073     .  0 0 "[    .    1    .    2]" 1 
       1472 1  71 THR H    1  71 THR MG   . . 4.000 3.946 3.899 3.984     .  0 0 "[    .    1    .    2]" 1 
       1473 1  71 THR H    1  72 TYR H    . . 4.530 4.420 4.370 4.484     .  0 0 "[    .    1    .    2]" 1 
       1474 1  71 THR HA   1  71 THR MG   . . 3.190 2.216 2.153 2.283     .  0 0 "[    .    1    .    2]" 1 
       1475 1  71 THR HA   1  72 TYR H    . . 2.720 2.232 2.194 2.293     .  0 0 "[    .    1    .    2]" 1 
       1476 1  71 THR HA   1  72 TYR QD   . . 4.150 3.885 3.531 4.119     .  0 0 "[    .    1    .    2]" 1 
       1477 1  71 THR HB   1  72 TYR H    . . 3.850 3.634 3.478 3.774     .  0 0 "[    .    1    .    2]" 1 
       1478 1  71 THR MG   1  72 TYR H    . . 3.430 2.271 1.948 2.469     .  0 0 "[    .    1    .    2]" 1 
       1479 1  72 TYR H    1  72 TYR HB3  . . 3.630 3.304 3.229 3.398     .  0 0 "[    .    1    .    2]" 1 
       1480 1  72 TYR H    1  72 TYR QD   . . 3.450 3.179 2.836 3.307     .  0 0 "[    .    1    .    2]" 1 
       1481 1  72 TYR H    1  72 TYR QE   . . 4.880 4.340 4.147 4.451     .  0 0 "[    .    1    .    2]" 1 
       1482 1  72 TYR H    1  73 VAL H    . . 4.700 4.414 4.392 4.440     .  0 0 "[    .    1    .    2]" 1 
       1483 1  72 TYR HA   1  72 TYR QD   . . 4.170 3.720 3.696 3.740     .  0 0 "[    .    1    .    2]" 1 
       1484 1  72 TYR HA   1  73 VAL H    . . 2.920 2.528 2.489 2.535     .  0 0 "[    .    1    .    2]" 1 
       1485 1  72 TYR HA   1  73 VAL HB   . . 4.860 4.522 4.408 4.738     .  0 0 "[    .    1    .    2]" 1 
       1486 1  72 TYR HA   1  73 VAL MG2  . . 4.020 3.456 3.214 3.605     .  0 0 "[    .    1    .    2]" 1 
       1487 1  72 TYR HB2  1  73 VAL H    . . 3.410 2.173 2.164 2.237     .  0 0 "[    .    1    .    2]" 1 
       1488 1  72 TYR HB3  1  73 VAL H    . . 3.600 3.606 3.586 3.624 0.024 14 0 "[    .    1    .    2]" 1 
       1489 1  72 TYR QD   1  73 VAL H    . . 4.130 2.983 2.870 3.240     .  0 0 "[    .    1    .    2]" 1 
       1490 1  72 TYR QD   1  74 VAL H    . . 4.990 3.565 3.053 3.976     .  0 0 "[    .    1    .    2]" 1 
       1491 1  72 TYR QD   1  74 VAL MG1  . . 3.370 2.536 2.243 2.981     .  0 0 "[    .    1    .    2]" 1 
       1492 1  72 TYR QD   1  74 VAL MG2  . . 4.150 3.809 3.585 4.045     .  0 0 "[    .    1    .    2]" 1 
       1493 1  72 TYR QD   1  82 LEU MD1  . . 4.030 3.883 3.673 4.021     .  0 0 "[    .    1    .    2]" 1 
       1494 1  72 TYR QE   1  72 TYR HH   . . 3.150 2.522 2.216 2.639     .  0 0 "[    .    1    .    2]" 1 
       1495 1  72 TYR QE   1  74 VAL MG1  . . 3.440 2.628 2.130 3.356     .  0 0 "[    .    1    .    2]" 1 
       1496 1  72 TYR QE   1  74 VAL MG2  . . 3.440 3.205 2.844 3.446 0.006  4 0 "[    .    1    .    2]" 1 
       1497 1  72 TYR QE   1  82 LEU MD1  . . 4.060 3.154 2.709 3.526     .  0 0 "[    .    1    .    2]" 1 
       1498 1  72 TYR QE   1  82 LEU MD2  . . 3.850 3.393 3.058 3.741     .  0 0 "[    .    1    .    2]" 1 
       1499 1  72 TYR QE   1  98 VAL MG1  . . 4.200 3.942 3.672 4.168     .  0 0 "[    .    1    .    2]" 1 
       1500 1  72 TYR HH   1  98 VAL MG1  . . 3.800 3.505 3.110 3.800     .  0 0 "[    .    1    .    2]" 1 
       1501 1  72 TYR HH   1  98 VAL MG2  . . 3.750 3.544 3.313 3.751 0.001 16 0 "[    .    1    .    2]" 1 
       1502 1  73 VAL H    1  73 VAL HB   . . 3.360 2.792 2.731 2.943     .  0 0 "[    .    1    .    2]" 1 
       1503 1  73 VAL H    1  73 VAL MG1  . . 4.150 3.892 3.847 3.977     .  0 0 "[    .    1    .    2]" 1 
       1504 1  73 VAL H    1  73 VAL MG2  . . 3.420 3.078 2.869 3.218     .  0 0 "[    .    1    .    2]" 1 
       1505 1  73 VAL HA   1  73 VAL MG1  . . 3.110 2.372 2.168 2.462     .  0 0 "[    .    1    .    2]" 1 
       1506 1  73 VAL HA   1  73 VAL MG2  . . 3.100 2.264 2.181 2.425     .  0 0 "[    .    1    .    2]" 1 
       1507 1  73 VAL HA   1  74 VAL H    . . 2.930 2.164 2.141 2.223     .  0 0 "[    .    1    .    2]" 1 
       1508 1  73 VAL HA   1  74 VAL HA   . . 4.480 4.399 4.389 4.425     .  0 0 "[    .    1    .    2]" 1 
       1509 1  73 VAL HA   1  74 VAL MG2  . . 4.130 3.700 3.598 3.849     .  0 0 "[    .    1    .    2]" 1 
       1510 1  73 VAL HB   1  74 VAL H    . . 4.860 4.190 3.979 4.377     .  0 0 "[    .    1    .    2]" 1 
       1511 1  73 VAL MG1  1  74 VAL H    . . 3.520 2.436 1.914 3.024     .  0 0 "[    .    1    .    2]" 1 
       1512 1  73 VAL MG1  1  75 LYS QD   . . 3.750 3.206 2.337 3.726     .  0 0 "[    .    1    .    2]" 1 
       1513 1  73 VAL MG1  1  75 LYS QE   . . 4.510 3.736 1.910 4.523 0.013 19 0 "[    .    1    .    2]" 1 
       1514 1  74 VAL H    1  74 VAL MG1  . . 3.750 2.822 2.482 3.026     .  0 0 "[    .    1    .    2]" 1 
       1515 1  74 VAL H    1  74 VAL MG2  . . 3.340 1.995 1.871 2.251     .  0 0 "[    .    1    .    2]" 1 
       1516 1  74 VAL HA   1  74 VAL MG1  . . 3.220 2.272 2.164 2.353     .  0 0 "[    .    1    .    2]" 1 
       1517 1  74 VAL HA   1  74 VAL MG2  . . 3.240 3.187 3.177 3.203     .  0 0 "[    .    1    .    2]" 1 
       1518 1  74 VAL HA   1  75 LYS H    . . 3.140 2.203 2.140 2.390     .  0 0 "[    .    1    .    2]" 1 
       1519 1  74 VAL HB   1  75 LYS H    . . 3.600 3.076 2.399 3.559     .  0 0 "[    .    1    .    2]" 1 
       1520 1  74 VAL HB   1  76 GLU H    . . 3.480 2.735 2.443 3.048     .  0 0 "[    .    1    .    2]" 1 
       1521 1  74 VAL HB   1  80 TYR QE   . . 3.940 3.220 2.662 3.562     .  0 0 "[    .    1    .    2]" 1 
       1522 1  74 VAL HB   1 100 VAL MG2  . . 4.400 4.054 3.602 4.394     .  0 0 "[    .    1    .    2]" 1 
       1523 1  74 VAL MG1  1  75 LYS H    . . 4.250 3.827 3.552 4.024     .  0 0 "[    .    1    .    2]" 1 
       1524 1  74 VAL MG1  1  76 GLU H    . . 4.800 4.215 4.058 4.450     .  0 0 "[    .    1    .    2]" 1 
       1525 1  74 VAL MG1  1  80 TYR QD   . . 4.100 3.220 2.723 3.698     .  0 0 "[    .    1    .    2]" 1 
       1526 1  74 VAL MG1  1  80 TYR QE   . . 3.630 2.375 1.815 3.204     .  0 0 "[    .    1    .    2]" 1 
       1527 1  74 VAL MG2  1  75 LYS H    . . 4.180 3.925 3.466 4.175     .  0 0 "[    .    1    .    2]" 1 
       1528 1  74 VAL MG2  1  76 GLU H    . . 4.400 3.586 2.956 4.242     .  0 0 "[    .    1    .    2]" 1 
       1529 1  74 VAL MG2  1  77 ARG HA   . . 4.340 4.099 3.750 4.271     .  0 0 "[    .    1    .    2]" 1 
       1530 1  74 VAL MG2  1  80 TYR QE   . . 3.880 3.666 3.443 3.877     .  0 0 "[    .    1    .    2]" 1 
       1531 1  74 VAL MG2  1 100 VAL MG1  . . 3.120 2.836 2.381 3.118     .  0 0 "[    .    1    .    2]" 1 
       1532 1  74 VAL MG2  1 100 VAL MG2  . . 3.030 2.621 2.270 2.890     .  0 0 "[    .    1    .    2]" 1 
       1533 1  75 LYS H    1  75 LYS HB2  . . 3.920 2.415 2.207 2.628     .  0 0 "[    .    1    .    2]" 1 
       1534 1  75 LYS H    1  75 LYS QB   . . 3.360 2.352 2.185 2.555     .  0 0 "[    .    1    .    2]" 1 
       1535 1  75 LYS H    1  75 LYS HB3  . . 3.920 3.378 2.835 3.727     .  0 0 "[    .    1    .    2]" 1 
       1536 1  75 LYS H    1  75 LYS HG2  . . 4.900 3.747 2.382 4.830     .  0 0 "[    .    1    .    2]" 1 
       1537 1  75 LYS H    1  75 LYS QG   . . 4.210 3.416 2.357 4.186     .  0 0 "[    .    1    .    2]" 1 
       1538 1  75 LYS H    1  75 LYS HG3  . . 4.900 4.198 3.666 4.614     .  0 0 "[    .    1    .    2]" 1 
       1539 1  75 LYS H    1  76 GLU H    . . 3.130 2.335 1.815 2.790     .  0 0 "[    .    1    .    2]" 1 
       1540 1  75 LYS H    1  80 TYR QE   . . 5.500 4.952 4.395 5.471     .  0 0 "[    .    1    .    2]" 1 
       1541 1  75 LYS HA   1  75 LYS QD   . . 3.620 2.270 1.988 3.171     .  0 0 "[    .    1    .    2]" 1 
       1542 1  75 LYS HA   1  75 LYS QE   . . 4.410 3.717 1.944 4.320     .  0 0 "[    .    1    .    2]" 1 
       1543 1  75 LYS HA   1  75 LYS HG2  . . 4.240 3.233 2.647 3.652     .  0 0 "[    .    1    .    2]" 1 
       1544 1  75 LYS HA   1  75 LYS QG   . . 3.600 2.606 2.168 2.960     .  0 0 "[    .    1    .    2]" 1 
       1545 1  75 LYS HA   1  75 LYS HG3  . . 4.240 3.114 2.189 3.826     .  0 0 "[    .    1    .    2]" 1 
       1546 1  75 LYS QB   1  75 LYS QD   . . 3.410 2.345 2.110 2.622     .  0 0 "[    .    1    .    2]" 1 
       1547 1  75 LYS QB   1  75 LYS QE   . . 3.770 3.118 2.006 3.801 0.031 13 0 "[    .    1    .    2]" 1 
       1548 1  75 LYS QB   1  76 GLU H    . . 3.700 3.294 2.781 3.699     .  0 0 "[    .    1    .    2]" 1 
       1549 1  75 LYS HB2  1  75 LYS QE   . . 4.480 3.687 2.037 4.334     .  0 0 "[    .    1    .    2]" 1 
       1550 1  75 LYS HB2  1  76 GLU H    . . 4.410 3.675 2.843 4.387     .  0 0 "[    .    1    .    2]" 1 
       1551 1  75 LYS HB3  1  75 LYS QE   . . 4.480 3.631 2.018 4.493 0.013 19 0 "[    .    1    .    2]" 1 
       1552 1  75 LYS HB3  1  76 GLU H    . . 4.410 3.900 2.971 4.396     .  0 0 "[    .    1    .    2]" 1 
       1553 1  75 LYS QE   1  75 LYS HG2  . . 3.620 2.761 2.151 3.482     .  0 0 "[    .    1    .    2]" 1 
       1554 1  75 LYS QE   1  75 LYS HG3  . . 3.620 2.573 2.106 3.479     .  0 0 "[    .    1    .    2]" 1 
       1555 1  76 GLU H    1  76 GLU QB   . . 3.150 2.588 2.337 2.889     .  0 0 "[    .    1    .    2]" 1 
       1556 1  76 GLU H    1  76 GLU HG2  . . 4.850 4.681 4.415 4.829     .  0 0 "[    .    1    .    2]" 1 
       1557 1  76 GLU H    1  76 GLU HG3  . . 4.850 4.641 4.421 4.854 0.004  3 0 "[    .    1    .    2]" 1 
       1558 1  76 GLU H    1  77 ARG H    . . 4.720 4.458 4.364 4.551     .  0 0 "[    .    1    .    2]" 1 
       1559 1  76 GLU H    1  80 TYR QE   . . 4.690 4.326 3.958 4.615     .  0 0 "[    .    1    .    2]" 1 
       1560 1  76 GLU H    1  80 TYR HH   . . 4.540 2.844 2.372 3.262     .  0 0 "[    .    1    .    2]" 1 
       1561 1  76 GLU HA   1  76 GLU HG2  . . 3.850 3.135 2.367 3.735     .  0 0 "[    .    1    .    2]" 1 
       1562 1  76 GLU HA   1  76 GLU QG   . . 3.380 2.433 2.239 2.958     .  0 0 "[    .    1    .    2]" 1 
       1563 1  76 GLU HA   1  76 GLU HG3  . . 3.850 2.640 2.291 3.568     .  0 0 "[    .    1    .    2]" 1 
       1564 1  76 GLU HA   1  77 ARG H    . . 3.000 2.394 2.269 2.523     .  0 0 "[    .    1    .    2]" 1 
       1565 1  76 GLU QB   1  77 ARG H    . . 3.590 3.213 3.032 3.443     .  0 0 "[    .    1    .    2]" 1 
       1566 1  76 GLU QB   1  80 TYR QE   . . 4.570 3.731 3.084 4.110     .  0 0 "[    .    1    .    2]" 1 
       1567 1  76 GLU HG2  1  77 ARG H    . . 4.000 2.449 1.883 3.793     .  0 0 "[    .    1    .    2]" 1 
       1568 1  76 GLU HG3  1  77 ARG H    . . 4.000 2.515 1.904 3.679     .  0 0 "[    .    1    .    2]" 1 
       1569 1  77 ARG H    1  77 ARG QB   . . 3.130 2.891 2.704 3.024     .  0 0 "[    .    1    .    2]" 1 
       1570 1  77 ARG H    1  77 ARG HD2  . . 4.830 4.157 1.913 4.724     .  0 0 "[    .    1    .    2]" 1 
       1571 1  77 ARG H    1  77 ARG QD   . . 4.090 3.167 1.864 4.078     .  0 0 "[    .    1    .    2]" 1 
       1572 1  77 ARG H    1  77 ARG HD3  . . 4.830 3.382 1.884 4.773     .  0 0 "[    .    1    .    2]" 1 
       1573 1  77 ARG H    1  77 ARG HG2  . . 3.880 2.290 1.907 3.886 0.006  6 0 "[    .    1    .    2]" 1 
       1574 1  77 ARG H    1  77 ARG QG   . . 3.350 2.150 1.889 2.718     .  0 0 "[    .    1    .    2]" 1 
       1575 1  77 ARG H    1  77 ARG HG3  . . 3.880 3.330 2.221 3.843     .  0 0 "[    .    1    .    2]" 1 
       1576 1  77 ARG HA   1  77 ARG HD2  . . 4.940 4.640 3.708 4.901     .  0 0 "[    .    1    .    2]" 1 
       1577 1  77 ARG HA   1  77 ARG HD3  . . 4.940 4.545 3.701 4.942 0.002 14 0 "[    .    1    .    2]" 1 
       1578 1  77 ARG HA   1  77 ARG QG   . . 3.730 3.296 2.620 3.441     .  0 0 "[    .    1    .    2]" 1 
       1579 1  77 ARG HA   1  78 GLY H    . . 3.040 2.482 2.216 2.644     .  0 0 "[    .    1    .    2]" 1 
       1580 1  77 ARG HA   1  78 GLY QA   . . 4.840 4.040 3.935 4.104     .  0 0 "[    .    1    .    2]" 1 
       1581 1  77 ARG HA   1  80 TYR QE   . . 4.530 2.608 2.332 2.965     .  0 0 "[    .    1    .    2]" 1 
       1582 1  77 ARG HA   1 100 VAL H    . . 4.990 4.583 4.375 4.884     .  0 0 "[    .    1    .    2]" 1 
       1583 1  77 ARG HA   1 100 VAL HB   . . 3.620 2.173 2.000 2.460     .  0 0 "[    .    1    .    2]" 1 
       1584 1  77 ARG HA   1 100 VAL MG1  . . 3.230 2.175 1.981 2.426     .  0 0 "[    .    1    .    2]" 1 
       1585 1  77 ARG HA   1 100 VAL MG2  . . 4.040 3.105 2.335 3.595     .  0 0 "[    .    1    .    2]" 1 
       1586 1  77 ARG QB   1  77 ARG QD   . . 3.020 2.140 2.033 2.281     .  0 0 "[    .    1    .    2]" 1 
       1587 1  77 ARG QB   1  78 GLY H    . . 3.290 2.301 2.007 2.904     .  0 0 "[    .    1    .    2]" 1 
       1588 1  77 ARG QB   1  78 GLY QA   . . 3.900 3.676 3.454 3.863     .  0 0 "[    .    1    .    2]" 1 
       1589 1  77 ARG HB2  1  77 ARG HD2  . . 4.220 2.901 2.374 3.679     .  0 0 "[    .    1    .    2]" 1 
       1590 1  77 ARG HB2  1  77 ARG HD3  . . 4.220 3.405 2.284 4.204     .  0 0 "[    .    1    .    2]" 1 
       1591 1  77 ARG HB2  1 100 VAL HB   . . 4.880 2.988 2.323 3.700     .  0 0 "[    .    1    .    2]" 1 
       1592 1  77 ARG HB2  1 100 VAL MG1  . . 3.800 2.594 2.078 3.740     .  0 0 "[    .    1    .    2]" 1 
       1593 1  77 ARG HB2  1 100 VAL MG2  . . 4.870 4.440 3.886 4.864     .  0 0 "[    .    1    .    2]" 1 
       1594 1  77 ARG HB3  1  77 ARG HD2  . . 4.220 2.728 2.086 4.196     .  0 0 "[    .    1    .    2]" 1 
       1595 1  77 ARG HB3  1  77 ARG HD3  . . 4.220 2.648 2.325 3.569     .  0 0 "[    .    1    .    2]" 1 
       1596 1  77 ARG HB3  1 100 VAL HB   . . 4.880 3.525 2.046 3.921     .  0 0 "[    .    1    .    2]" 1 
       1597 1  77 ARG HB3  1 100 VAL MG1  . . 3.800 2.290 1.976 2.599     .  0 0 "[    .    1    .    2]" 1 
       1598 1  77 ARG HB3  1 100 VAL MG2  . . 4.870 4.544 3.670 4.863     .  0 0 "[    .    1    .    2]" 1 
       1599 1  77 ARG QG   1  78 GLY H    . . 4.380 3.522 3.045 4.055     .  0 0 "[    .    1    .    2]" 1 
       1600 1  77 ARG HG2  1  78 GLY H    . . 5.130 4.282 3.600 4.835     .  0 0 "[    .    1    .    2]" 1 
       1601 1  77 ARG HG3  1  78 GLY H    . . 5.130 3.849 3.137 4.883     .  0 0 "[    .    1    .    2]" 1 
       1602 1  78 GLY H    1  79 ASP H    . . 4.920 4.433 4.196 4.532     .  0 0 "[    .    1    .    2]" 1 
       1603 1  78 GLY H    1  80 TYR QE   . . 4.380 3.553 2.946 4.072     .  0 0 "[    .    1    .    2]" 1 
       1604 1  78 GLY H    1 100 VAL H    . . 3.840 2.897 2.694 3.154     .  0 0 "[    .    1    .    2]" 1 
       1605 1  78 GLY H    1 100 VAL HB   . . 3.080 1.984 1.899 2.208     .  0 0 "[    .    1    .    2]" 1 
       1606 1  78 GLY H    1 100 VAL MG1  . . 3.600 3.254 2.979 3.582     .  0 0 "[    .    1    .    2]" 1 
       1607 1  78 GLY H    1 100 VAL MG2  . . 3.950 3.476 3.003 3.797     .  0 0 "[    .    1    .    2]" 1 
       1608 1  78 GLY QA   1  79 ASP H    . . 2.780 2.200 2.112 2.283     .  0 0 "[    .    1    .    2]" 1 
       1609 1  78 GLY HA2  1  79 ASP H    . . 3.220 2.885 2.550 3.183     .  0 0 "[    .    1    .    2]" 1 
       1610 1  78 GLY HA3  1  79 ASP H    . . 3.220 2.305 2.143 2.575     .  0 0 "[    .    1    .    2]" 1 
       1611 1  79 ASP H    1  79 ASP HB2  . . 3.820 3.073 2.376 3.701     .  0 0 "[    .    1    .    2]" 1 
       1612 1  79 ASP H    1  79 ASP QB   . . 3.050 2.602 2.197 2.984     .  0 0 "[    .    1    .    2]" 1 
       1613 1  79 ASP H    1  79 ASP HB3  . . 3.820 3.161 2.251 3.693     .  0 0 "[    .    1    .    2]" 1 
       1614 1  79 ASP H    1  80 TYR H    . . 4.650 4.372 4.158 4.553     .  0 0 "[    .    1    .    2]" 1 
       1615 1  79 ASP HA   1  80 TYR H    . . 2.810 2.158 2.139 2.197     .  0 0 "[    .    1    .    2]" 1 
       1616 1  79 ASP HA   1  98 VAL H    . . 5.210 5.072 4.839 5.211 0.001  4 0 "[    .    1    .    2]" 1 
       1617 1  79 ASP HA   1  99 THR HA   . . 3.440 2.952 2.642 3.342     .  0 0 "[    .    1    .    2]" 1 
       1618 1  79 ASP HA   1 100 VAL H    . . 4.250 3.923 3.551 4.211     .  0 0 "[    .    1    .    2]" 1 
       1619 1  79 ASP QB   1  80 TYR H    . . 3.700 3.451 3.140 3.694     .  0 0 "[    .    1    .    2]" 1 
       1620 1  79 ASP HB2  1  80 TYR H    . . 4.430 3.966 3.321 4.382     .  0 0 "[    .    1    .    2]" 1 
       1621 1  79 ASP HB3  1  80 TYR H    . . 4.430 3.978 3.242 4.399     .  0 0 "[    .    1    .    2]" 1 
       1622 1  80 TYR H    1  80 TYR HB2  . . 3.850 2.368 2.207 2.525     .  0 0 "[    .    1    .    2]" 1 
       1623 1  80 TYR H    1  80 TYR QB   . . 3.160 2.336 2.185 2.481     .  0 0 "[    .    1    .    2]" 1 
       1624 1  80 TYR H    1  80 TYR HB3  . . 3.850 3.584 3.500 3.644     .  0 0 "[    .    1    .    2]" 1 
       1625 1  80 TYR H    1  80 TYR QD   . . 3.580 2.913 2.495 3.251     .  0 0 "[    .    1    .    2]" 1 
       1626 1  80 TYR H    1  80 TYR QE   . . 5.500 5.131 4.739 5.459     .  0 0 "[    .    1    .    2]" 1 
       1627 1  80 TYR H    1  81 VAL H    . . 4.610 4.526 4.461 4.592     .  0 0 "[    .    1    .    2]" 1 
       1628 1  80 TYR H    1  81 VAL MG2  . . 5.470 4.520 4.261 4.830     .  0 0 "[    .    1    .    2]" 1 
       1629 1  80 TYR H    1  98 VAL H    . . 3.790 3.565 3.158 3.792 0.002 11 0 "[    .    1    .    2]" 1 
       1630 1  80 TYR H    1  98 VAL HB   . . 4.120 3.591 3.311 3.863     .  0 0 "[    .    1    .    2]" 1 
       1631 1  80 TYR H    1  98 VAL MG1  . . 4.330 4.015 3.736 4.287     .  0 0 "[    .    1    .    2]" 1 
       1632 1  80 TYR H    1  99 THR HA   . . 4.450 3.408 3.031 3.853     .  0 0 "[    .    1    .    2]" 1 
       1633 1  80 TYR H    1 100 VAL H    . . 5.190 4.464 4.069 4.871     .  0 0 "[    .    1    .    2]" 1 
       1634 1  80 TYR H    1 100 VAL MG2  . . 5.500 4.243 3.435 4.631     .  0 0 "[    .    1    .    2]" 1 
       1635 1  80 TYR HA   1  80 TYR QD   . . 4.170 2.997 2.813 3.065     .  0 0 "[    .    1    .    2]" 1 
       1636 1  80 TYR HA   1  81 VAL H    . . 2.990 2.345 2.225 2.447     .  0 0 "[    .    1    .    2]" 1 
       1637 1  80 TYR HA   1  81 VAL HB   . . 4.690 4.547 4.382 4.680     .  0 0 "[    .    1    .    2]" 1 
       1638 1  80 TYR HA   1  98 VAL HB   . . 5.130 4.667 4.403 5.036     .  0 0 "[    .    1    .    2]" 1 
       1639 1  80 TYR QB   1  81 VAL H    . . 3.390 2.591 2.370 2.906     .  0 0 "[    .    1    .    2]" 1 
       1640 1  80 TYR QB   1  98 VAL H    . . 3.890 3.513 3.286 3.829     .  0 0 "[    .    1    .    2]" 1 
       1641 1  80 TYR QB   1  98 VAL HB   . . 3.410 2.108 1.961 2.427     .  0 0 "[    .    1    .    2]" 1 
       1642 1  80 TYR QB   1  98 VAL MG1  . . 3.620 2.627 2.140 3.078     .  0 0 "[    .    1    .    2]" 1 
       1643 1  80 TYR QB   1  98 VAL MG2  . . 3.740 3.439 3.248 3.734     .  0 0 "[    .    1    .    2]" 1 
       1644 1  80 TYR QB   1 100 VAL MG2  . . 4.430 3.373 3.136 3.719     .  0 0 "[    .    1    .    2]" 1 
       1645 1  80 TYR HB2  1  81 VAL H    . . 4.170 3.942 3.793 4.165     .  0 0 "[    .    1    .    2]" 1 
       1646 1  80 TYR HB2  1  98 VAL H    . . 4.630 3.736 3.490 4.108     .  0 0 "[    .    1    .    2]" 1 
       1647 1  80 TYR HB2  1  98 VAL HB   . . 3.990 2.188 2.018 2.581     .  0 0 "[    .    1    .    2]" 1 
       1648 1  80 TYR HB2  1  98 VAL MG1  . . 4.150 2.703 2.192 3.191     .  0 0 "[    .    1    .    2]" 1 
       1649 1  80 TYR HB2  1  98 VAL MG2  . . 4.370 3.834 3.668 4.152     .  0 0 "[    .    1    .    2]" 1 
       1650 1  80 TYR HB3  1  81 VAL H    . . 4.170 2.629 2.394 2.967     .  0 0 "[    .    1    .    2]" 1 
       1651 1  80 TYR HB3  1  98 VAL H    . . 4.630 4.285 3.960 4.576     .  0 0 "[    .    1    .    2]" 1 
       1652 1  80 TYR HB3  1  98 VAL HB   . . 3.990 2.813 2.410 3.163     .  0 0 "[    .    1    .    2]" 1 
       1653 1  80 TYR HB3  1  98 VAL MG1  . . 4.150 3.599 2.982 4.042     .  0 0 "[    .    1    .    2]" 1 
       1654 1  80 TYR HB3  1  98 VAL MG2  . . 4.370 3.900 3.547 4.277     .  0 0 "[    .    1    .    2]" 1 
       1655 1  80 TYR QD   1  81 VAL H    . . 4.690 3.404 3.048 4.041     .  0 0 "[    .    1    .    2]" 1 
       1656 1  80 TYR QD   1  98 VAL HB   . . 4.710 4.169 3.989 4.518     .  0 0 "[    .    1    .    2]" 1 
       1657 1  80 TYR QD   1 100 VAL H    . . 4.570 3.801 3.522 4.235     .  0 0 "[    .    1    .    2]" 1 
       1658 1  80 TYR QD   1 100 VAL HB   . . 4.570 3.574 2.975 4.144     .  0 0 "[    .    1    .    2]" 1 
       1659 1  80 TYR QD   1 100 VAL MG2  . . 3.550 2.420 1.994 3.070     .  0 0 "[    .    1    .    2]" 1 
       1660 1  80 TYR QE   1 100 VAL H    . . 5.070 4.849 4.621 5.033     .  0 0 "[    .    1    .    2]" 1 
       1661 1  80 TYR QE   1 100 VAL HB   . . 3.820 3.210 2.806 3.816     .  0 0 "[    .    1    .    2]" 1 
       1662 1  80 TYR QE   1 100 VAL MG1  . . 4.110 3.745 3.389 4.027     .  0 0 "[    .    1    .    2]" 1 
       1663 1  80 TYR QE   1 100 VAL MG2  . . 3.550 2.703 2.084 3.316     .  0 0 "[    .    1    .    2]" 1 
       1664 1  81 VAL H    1  81 VAL HB   . . 3.360 2.700 2.581 2.814     .  0 0 "[    .    1    .    2]" 1 
       1665 1  81 VAL H    1  81 VAL MG1  . . 4.280 3.864 3.823 3.902     .  0 0 "[    .    1    .    2]" 1 
       1666 1  81 VAL H    1  81 VAL MG2  . . 3.430 2.922 2.615 3.204     .  0 0 "[    .    1    .    2]" 1 
       1667 1  81 VAL H    1  82 LEU H    . . 4.390 4.100 3.921 4.334     .  0 0 "[    .    1    .    2]" 1 
       1668 1  81 VAL HA   1  81 VAL MG1  . . 3.380 2.408 2.293 2.466     .  0 0 "[    .    1    .    2]" 1 
       1669 1  81 VAL HA   1  81 VAL MG2  . . 3.320 2.300 2.166 2.434     .  0 0 "[    .    1    .    2]" 1 
       1670 1  81 VAL HA   1  82 LEU H    . . 2.840 2.160 2.140 2.183     .  0 0 "[    .    1    .    2]" 1 
       1671 1  81 VAL HA   1  82 LEU HB3  . . 4.990 4.481 4.412 4.535     .  0 0 "[    .    1    .    2]" 1 
       1672 1  81 VAL HA   1  97 HIS HA   . . 4.060 3.632 3.178 3.943     .  0 0 "[    .    1    .    2]" 1 
       1673 1  81 VAL HA   1  98 VAL H    . . 4.130 3.585 3.124 3.967     .  0 0 "[    .    1    .    2]" 1 
       1674 1  81 VAL HB   1  82 LEU H    . . 4.490 4.357 4.124 4.468     .  0 0 "[    .    1    .    2]" 1 
       1675 1  81 VAL MG1  1  82 LEU H    . . 3.510 2.925 2.267 3.223     .  0 0 "[    .    1    .    2]" 1 
       1676 1  81 VAL MG1  1  82 LEU HA   . . 4.360 3.913 3.564 4.099     .  0 0 "[    .    1    .    2]" 1 
       1677 1  81 VAL MG1  1  83 ALA H    . . 4.530 4.124 3.786 4.447     .  0 0 "[    .    1    .    2]" 1 
       1678 1  81 VAL MG1  1  95 PRO HA   . . 4.300 3.648 3.234 3.863     .  0 0 "[    .    1    .    2]" 1 
       1679 1  81 VAL MG1  1  95 PRO HB2  . . 3.630 2.029 1.892 2.285     .  0 0 "[    .    1    .    2]" 1 
       1680 1  81 VAL MG1  1  95 PRO QB   . . 2.990 1.952 1.852 2.169     .  0 0 "[    .    1    .    2]" 1 
       1681 1  81 VAL MG1  1  95 PRO HB3  . . 3.630 2.560 2.308 2.742     .  0 0 "[    .    1    .    2]" 1 
       1682 1  81 VAL MG1  1  95 PRO HG2  . . 4.350 3.682 3.431 3.937     .  0 0 "[    .    1    .    2]" 1 
       1683 1  81 VAL MG1  1  95 PRO HG3  . . 4.350 3.450 3.134 3.632     .  0 0 "[    .    1    .    2]" 1 
       1684 1  81 VAL MG1  1  96 PHE H    . . 4.400 3.908 3.304 4.220     .  0 0 "[    .    1    .    2]" 1 
       1685 1  81 VAL MG2  1  82 LEU H    . . 4.190 4.116 3.946 4.191 0.001 19 0 "[    .    1    .    2]" 1 
       1686 1  81 VAL MG2  1  97 HIS HA   . . 4.400 4.034 3.305 4.355     .  0 0 "[    .    1    .    2]" 1 
       1687 1  81 VAL MG2  1  97 HIS HD2  . . 4.820 4.176 3.225 4.534     .  0 0 "[    .    1    .    2]" 1 
       1688 1  81 VAL MG2  1  98 VAL H    . . 4.910 4.436 3.618 4.817     .  0 0 "[    .    1    .    2]" 1 
       1689 1  82 LEU H    1  82 LEU HB2  . . 3.780 2.901 2.788 3.138     .  0 0 "[    .    1    .    2]" 1 
       1690 1  82 LEU H    1  82 LEU HB3  . . 3.450 2.365 2.280 2.496     .  0 0 "[    .    1    .    2]" 1 
       1691 1  82 LEU H    1  82 LEU MD1  . . 4.350 4.282 4.209 4.347     .  0 0 "[    .    1    .    2]" 1 
       1692 1  82 LEU H    1  82 LEU MD2  . . 4.430 4.239 4.147 4.391     .  0 0 "[    .    1    .    2]" 1 
       1693 1  82 LEU H    1  82 LEU HG   . . 4.430 4.324 4.265 4.376     .  0 0 "[    .    1    .    2]" 1 
       1694 1  82 LEU H    1  83 ALA H    . . 4.750 4.417 4.215 4.544     .  0 0 "[    .    1    .    2]" 1 
       1695 1  82 LEU H    1  95 PRO HA   . . 4.780 4.601 4.146 4.779     .  0 0 "[    .    1    .    2]" 1 
       1696 1  82 LEU H    1  96 PHE H    . . 3.760 3.319 3.052 3.567     .  0 0 "[    .    1    .    2]" 1 
       1697 1  82 LEU H    1  96 PHE HB2  . . 4.290 3.414 3.137 3.608     .  0 0 "[    .    1    .    2]" 1 
       1698 1  82 LEU H    1  96 PHE HB3  . . 4.780 4.317 3.978 4.542     .  0 0 "[    .    1    .    2]" 1 
       1699 1  82 LEU H    1  96 PHE QD   . . 5.130 5.044 4.867 5.130     .  0 0 "[    .    1    .    2]" 1 
       1700 1  82 LEU H    1  98 VAL H    . . 4.640 4.009 3.800 4.485     .  0 0 "[    .    1    .    2]" 1 
       1701 1  82 LEU H    1  98 VAL MG2  . . 4.050 3.427 3.094 3.890     .  0 0 "[    .    1    .    2]" 1 
       1702 1  82 LEU HA   1  82 LEU MD1  . . 3.450 2.263 2.002 2.450     .  0 0 "[    .    1    .    2]" 1 
       1703 1  82 LEU HA   1  82 LEU MD2  . . 4.090 3.938 3.895 3.982     .  0 0 "[    .    1    .    2]" 1 
       1704 1  82 LEU HA   1  82 LEU HG   . . 4.110 3.223 3.156 3.290     .  0 0 "[    .    1    .    2]" 1 
       1705 1  82 LEU HA   1  83 ALA H    . . 2.830 2.148 2.139 2.202     .  0 0 "[    .    1    .    2]" 1 
       1706 1  82 LEU HB2  1  82 LEU MD1  . . 3.610 2.261 2.179 2.421     .  0 0 "[    .    1    .    2]" 1 
       1707 1  82 LEU HB2  1  82 LEU MD2  . . 3.550 2.431 2.283 2.541     .  0 0 "[    .    1    .    2]" 1 
       1708 1  82 LEU HB2  1  84 VAL MG2  . . 5.080 4.576 4.433 4.759     .  0 0 "[    .    1    .    2]" 1 
       1709 1  82 LEU HB2  1  96 PHE H    . . 5.030 4.786 4.611 4.919     .  0 0 "[    .    1    .    2]" 1 
       1710 1  82 LEU HB2  1  96 PHE HB2  . . 4.240 3.716 3.657 3.821     .  0 0 "[    .    1    .    2]" 1 
       1711 1  82 LEU HB2  1  96 PHE HB3  . . 4.810 4.704 4.577 4.795     .  0 0 "[    .    1    .    2]" 1 
       1712 1  82 LEU HB2  1  96 PHE QD   . . 5.410 5.235 5.091 5.380     .  0 0 "[    .    1    .    2]" 1 
       1713 1  82 LEU HB2  1  98 VAL MG2  . . 3.660 2.844 2.567 3.111     .  0 0 "[    .    1    .    2]" 1 
       1714 1  82 LEU HB3  1  82 LEU MD2  . . 3.420 2.242 2.134 2.383     .  0 0 "[    .    1    .    2]" 1 
       1715 1  82 LEU HB3  1  83 ALA H    . . 4.480 4.332 4.127 4.448     .  0 0 "[    .    1    .    2]" 1 
       1716 1  82 LEU HB3  1  84 VAL MG2  . . 4.430 4.149 4.000 4.406     .  0 0 "[    .    1    .    2]" 1 
       1717 1  82 LEU HB3  1  96 PHE H    . . 4.050 3.121 2.920 3.287     .  0 0 "[    .    1    .    2]" 1 
       1718 1  82 LEU HB3  1  96 PHE HB2  . . 3.980 2.042 2.001 2.100     .  0 0 "[    .    1    .    2]" 1 
       1719 1  82 LEU HB3  1  96 PHE HB3  . . 4.170 3.347 3.194 3.446     .  0 0 "[    .    1    .    2]" 1 
       1720 1  82 LEU HB3  1  96 PHE QD   . . 4.090 3.733 3.572 3.926     .  0 0 "[    .    1    .    2]" 1 
       1721 1  82 LEU HB3  1  98 VAL MG2  . . 4.290 3.097 2.869 3.356     .  0 0 "[    .    1    .    2]" 1 
       1722 1  82 LEU MD1  1  83 ALA H    . . 3.600 2.595 2.291 2.933     .  0 0 "[    .    1    .    2]" 1 
       1723 1  82 LEU MD1  1  84 VAL MG2  . . 3.420 2.381 2.171 2.784     .  0 0 "[    .    1    .    2]" 1 
       1724 1  82 LEU MD1  1  96 PHE HB2  . . 4.800 4.616 4.495 4.717     .  0 0 "[    .    1    .    2]" 1 
       1725 1  82 LEU MD1  1  96 PHE QD   . . 5.320 5.011 4.804 5.119     .  0 0 "[    .    1    .    2]" 1 
       1726 1  82 LEU MD2  1  84 VAL MG2  . . 3.620 2.404 2.234 2.544     .  0 0 "[    .    1    .    2]" 1 
       1727 1  82 LEU MD2  1  96 PHE HB2  . . 3.800 2.655 2.354 2.952     .  0 0 "[    .    1    .    2]" 1 
       1728 1  82 LEU MD2  1  96 PHE HB3  . . 4.030 3.497 3.206 3.739     .  0 0 "[    .    1    .    2]" 1 
       1729 1  82 LEU MD2  1  96 PHE QD   . . 3.860 3.266 2.944 3.576     .  0 0 "[    .    1    .    2]" 1 
       1730 1  82 LEU HG   1  83 ALA H    . . 4.670 3.358 2.827 3.628     .  0 0 "[    .    1    .    2]" 1 
       1731 1  82 LEU HG   1  84 VAL H    . . 5.320 3.817 3.677 4.052     .  0 0 "[    .    1    .    2]" 1 
       1732 1  82 LEU HG   1  84 VAL MG2  . . 3.560 2.108 1.973 2.368     .  0 0 "[    .    1    .    2]" 1 
       1733 1  82 LEU HG   1  96 PHE HB2  . . 4.390 3.572 3.338 3.718     .  0 0 "[    .    1    .    2]" 1 
       1734 1  82 LEU HG   1  96 PHE HB3  . . 5.390 5.186 4.969 5.361     .  0 0 "[    .    1    .    2]" 1 
       1735 1  82 LEU HG   1  96 PHE QD   . . 3.850 3.697 3.449 3.845     .  0 0 "[    .    1    .    2]" 1 
       1736 1  83 ALA H    1  83 ALA MB   . . 3.210 2.396 2.262 2.531     .  0 0 "[    .    1    .    2]" 1 
       1737 1  83 ALA HA   1  84 VAL H    . . 2.860 2.152 2.142 2.164     .  0 0 "[    .    1    .    2]" 1 
       1738 1  83 ALA HA   1  84 VAL MG2  . . 4.410 3.721 3.388 3.918     .  0 0 "[    .    1    .    2]" 1 
       1739 1  83 ALA HA   1  90 HIS HE1  . . 5.260 4.799 4.661 5.050     .  0 0 "[    .    1    .    2]" 1 
       1740 1  83 ALA HA   1  94 SER HA   . . 4.900 4.755 4.569 4.865     .  0 0 "[    .    1    .    2]" 1 
       1741 1  83 ALA HA   1  94 SER HG   . . 4.440 3.314 3.190 3.458     .  0 0 "[    .    1    .    2]" 1 
       1742 1  83 ALA HA   1  95 PRO HA   . . 4.020 3.067 2.960 3.204     .  0 0 "[    .    1    .    2]" 1 
       1743 1  83 ALA HA   1  95 PRO QB   . . 4.700 3.664 3.482 3.871     .  0 0 "[    .    1    .    2]" 1 
       1744 1  83 ALA HA   1  96 PHE H    . . 4.200 4.038 3.846 4.189     .  0 0 "[    .    1    .    2]" 1 
       1745 1  83 ALA MB   1  84 VAL H    . . 3.750 3.358 3.276 3.433     .  0 0 "[    .    1    .    2]" 1 
       1746 1  83 ALA MB   1  90 HIS HE1  . . 3.590 3.251 3.120 3.474     .  0 0 "[    .    1    .    2]" 1 
       1747 1  83 ALA MB   1  94 SER HG   . . 4.060 3.988 3.744 4.063 0.003 11 0 "[    .    1    .    2]" 1 
       1748 1  83 ALA MB   1  95 PRO HA   . . 4.200 4.081 3.838 4.198     .  0 0 "[    .    1    .    2]" 1 
       1749 1  84 VAL H    1  84 VAL HB   . . 3.860 2.687 2.622 2.827     .  0 0 "[    .    1    .    2]" 1 
       1750 1  84 VAL H    1  84 VAL MG2  . . 3.690 2.669 2.341 2.848     .  0 0 "[    .    1    .    2]" 1 
       1751 1  84 VAL H    1  91 ILE H    . . 5.350 4.973 4.816 5.098     .  0 0 "[    .    1    .    2]" 1 
       1752 1  84 VAL H    1  91 ILE MD   . . 4.780 3.841 3.652 4.266     .  0 0 "[    .    1    .    2]" 1 
       1753 1  84 VAL H    1  94 SER HB2  . . 4.310 2.709 2.614 2.806     .  0 0 "[    .    1    .    2]" 1 
       1754 1  84 VAL H    1  94 SER HB3  . . 3.990 3.334 3.158 3.498     .  0 0 "[    .    1    .    2]" 1 
       1755 1  84 VAL H    1  94 SER HG   . . 3.700 3.112 2.920 3.350     .  0 0 "[    .    1    .    2]" 1 
       1756 1  84 VAL H    1  95 PRO HA   . . 4.480 4.099 3.953 4.257     .  0 0 "[    .    1    .    2]" 1 
       1757 1  84 VAL HA   1  84 VAL MG1  . . 3.380 2.329 2.220 2.455     .  0 0 "[    .    1    .    2]" 1 
       1758 1  84 VAL HA   1  84 VAL MG2  . . 3.590 2.415 2.283 2.584     .  0 0 "[    .    1    .    2]" 1 
       1759 1  84 VAL HB   1  85 LYS H    . . 4.670 4.202 4.085 4.298     .  0 0 "[    .    1    .    2]" 1 
       1760 1  84 VAL HB   1  91 ILE H    . . 4.930 4.085 3.982 4.242     .  0 0 "[    .    1    .    2]" 1 
       1761 1  84 VAL HB   1  91 ILE MD   . . 3.170 2.009 1.893 2.161     .  0 0 "[    .    1    .    2]" 1 
       1762 1  84 VAL HB   1  91 ILE HG12 . . 3.910 2.111 2.001 2.286     .  0 0 "[    .    1    .    2]" 1 
       1763 1  84 VAL HB   1  91 ILE HG13 . . 4.180 3.449 3.309 3.628     .  0 0 "[    .    1    .    2]" 1 
       1764 1  84 VAL HB   1  91 ILE MG   . . 3.330 3.106 2.955 3.314     .  0 0 "[    .    1    .    2]" 1 
       1765 1  84 VAL HB   1  94 SER HB2  . . 4.710 3.525 3.324 3.785     .  0 0 "[    .    1    .    2]" 1 
       1766 1  84 VAL HB   1  94 SER HB3  . . 4.620 3.895 3.651 4.122     .  0 0 "[    .    1    .    2]" 1 
       1767 1  84 VAL HB   1  96 PHE QE   . . 4.310 4.100 3.760 4.311 0.001 14 0 "[    .    1    .    2]" 1 
       1768 1  84 VAL MG1  1  85 LYS H    . . 3.370 2.605 2.332 2.895     .  0 0 "[    .    1    .    2]" 1 
       1769 1  84 VAL MG1  1  91 ILE HG12 . . 3.820 2.967 2.679 3.222     .  0 0 "[    .    1    .    2]" 1 
       1770 1  84 VAL MG1  1  91 ILE HG13 . . 4.410 4.268 4.014 4.409     .  0 0 "[    .    1    .    2]" 1 
       1771 1  84 VAL MG2  1  91 ILE HG12 . . 4.640 3.753 3.653 3.903     .  0 0 "[    .    1    .    2]" 1 
       1772 1  84 VAL MG2  1  91 ILE HG13 . . 5.450 4.548 4.250 4.722     .  0 0 "[    .    1    .    2]" 1 
       1773 1  84 VAL MG2  1  94 SER HB3  . . 5.260 4.596 4.160 4.873     .  0 0 "[    .    1    .    2]" 1 
       1774 1  84 VAL MG2  1  96 PHE QD   . . 3.790 3.603 3.352 3.789     .  0 0 "[    .    1    .    2]" 1 
       1775 1  84 VAL MG2  1  96 PHE QE   . . 4.210 4.066 3.795 4.207     .  0 0 "[    .    1    .    2]" 1 
       1776 1  85 LYS H    1  85 LYS HB2  . . 3.500 2.421 2.340 2.541     .  0 0 "[    .    1    .    2]" 1 
       1777 1  85 LYS H    1  85 LYS HB3  . . 3.880 3.639 3.586 3.716     .  0 0 "[    .    1    .    2]" 1 
       1778 1  85 LYS H    1  85 LYS HG2  . . 4.370 4.102 4.010 4.205     .  0 0 "[    .    1    .    2]" 1 
       1779 1  85 LYS H    1  85 LYS HG3  . . 3.380 3.162 2.996 3.276     .  0 0 "[    .    1    .    2]" 1 
       1780 1  85 LYS H    1  86 TRP H    . . 4.570 4.522 4.479 4.551     .  0 0 "[    .    1    .    2]" 1 
       1781 1  85 LYS H    1  91 ILE H    . . 5.500 4.982 4.853 5.111     .  0 0 "[    .    1    .    2]" 1 
       1782 1  85 LYS HA   1  85 LYS QD   . . 4.840 4.124 4.099 4.169     .  0 0 "[    .    1    .    2]" 1 
       1783 1  85 LYS HA   1  85 LYS HE3  . . 4.860 4.252 4.019 4.565     .  0 0 "[    .    1    .    2]" 1 
       1784 1  85 LYS HA   1  85 LYS HG2  . . 4.220 2.405 2.326 2.499     .  0 0 "[    .    1    .    2]" 1 
       1785 1  85 LYS HA   1  85 LYS HG3  . . 4.230 2.981 2.891 3.048     .  0 0 "[    .    1    .    2]" 1 
       1786 1  85 LYS HA   1  86 TRP H    . . 2.830 2.310 2.289 2.332     .  0 0 "[    .    1    .    2]" 1 
       1787 1  85 LYS HA   1  89 GLU H    . . 4.910 4.136 4.062 4.243     .  0 0 "[    .    1    .    2]" 1 
       1788 1  85 LYS HA   1  90 HIS H    . . 4.770 4.580 4.480 4.694     .  0 0 "[    .    1    .    2]" 1 
       1789 1  85 LYS HA   1  90 HIS HA   . . 3.750 2.164 2.026 2.311     .  0 0 "[    .    1    .    2]" 1 
       1790 1  85 LYS HA   1  91 ILE H    . . 3.650 2.895 2.732 2.982     .  0 0 "[    .    1    .    2]" 1 
       1791 1  85 LYS HA   1  91 ILE MG   . . 3.960 3.452 3.236 3.574     .  0 0 "[    .    1    .    2]" 1 
       1792 1  85 LYS HB2  1  85 LYS HD2  . . 4.150 3.591 3.533 3.671     .  0 0 "[    .    1    .    2]" 1 
       1793 1  85 LYS HB2  1  85 LYS QD   . . 3.580 2.389 2.304 2.482     .  0 0 "[    .    1    .    2]" 1 
       1794 1  85 LYS HB2  1  85 LYS HD3  . . 4.150 2.425 2.335 2.524     .  0 0 "[    .    1    .    2]" 1 
       1795 1  85 LYS HB2  1  85 LYS HE2  . . 4.670 3.521 3.215 3.675     .  0 0 "[    .    1    .    2]" 1 
       1796 1  85 LYS HB2  1  85 LYS HE3  . . 4.250 4.201 4.114 4.250     . 11 0 "[    .    1    .    2]" 1 
       1797 1  85 LYS HB2  1  86 TRP H    . . 3.990 3.945 3.856 3.990     . 14 0 "[    .    1    .    2]" 1 
       1798 1  85 LYS HB2  1  87 GLY H    . . 5.500 4.982 4.704 5.233     .  0 0 "[    .    1    .    2]" 1 
       1799 1  85 LYS HB2  1  88 GLU H    . . 5.390 5.110 4.999 5.224     .  0 0 "[    .    1    .    2]" 1 
       1800 1  85 LYS HB2  1  89 GLU H    . . 4.610 4.575 4.520 4.613 0.003 19 0 "[    .    1    .    2]" 1 
       1801 1  85 LYS HB3  1  85 LYS HD2  . . 4.090 3.712 3.666 3.761     .  0 0 "[    .    1    .    2]" 1 
       1802 1  85 LYS HB3  1  85 LYS QD   . . 3.530 2.643 2.559 2.783     .  0 0 "[    .    1    .    2]" 1 
       1803 1  85 LYS HB3  1  85 LYS HD3  . . 4.090 2.706 2.612 2.870     .  0 0 "[    .    1    .    2]" 1 
       1804 1  85 LYS HB3  1  85 LYS HE2  . . 4.290 2.384 2.110 2.535     .  0 0 "[    .    1    .    2]" 1 
       1805 1  85 LYS HB3  1  85 LYS HE3  . . 3.760 3.154 2.951 3.301     .  0 0 "[    .    1    .    2]" 1 
       1806 1  85 LYS HB3  1  86 TRP H    . . 3.440 2.685 2.623 2.741     .  0 0 "[    .    1    .    2]" 1 
       1807 1  85 LYS HB3  1  88 GLU H    . . 4.840 3.827 3.697 4.001     .  0 0 "[    .    1    .    2]" 1 
       1808 1  85 LYS HB3  1  89 GLU H    . . 4.280 2.825 2.769 2.874     .  0 0 "[    .    1    .    2]" 1 
       1809 1  85 LYS HB3  1  90 HIS HA   . . 4.580 4.185 4.041 4.351     .  0 0 "[    .    1    .    2]" 1 
       1810 1  85 LYS QD   1  90 HIS HE1  . . 4.850 3.514 3.090 3.815     .  0 0 "[    .    1    .    2]" 1 
       1811 1  85 LYS HE2  1  85 LYS HG2  . . 4.180 3.007 2.856 3.131     .  0 0 "[    .    1    .    2]" 1 
       1812 1  85 LYS HE2  1  85 LYS HG3  . . 4.090 3.874 3.741 3.951     .  0 0 "[    .    1    .    2]" 1 
       1813 1  85 LYS HE2  1  86 TRP H    . . 5.200 4.372 4.169 4.592     .  0 0 "[    .    1    .    2]" 1 
       1814 1  85 LYS HE2  1  88 GLU H    . . 5.390 3.488 3.165 3.755     .  0 0 "[    .    1    .    2]" 1 
       1815 1  85 LYS HE2  1  88 GLU HA   . . 4.770 2.773 2.576 3.016     .  0 0 "[    .    1    .    2]" 1 
       1816 1  85 LYS HE2  1  89 GLU H    . . 4.010 2.708 2.378 3.073     .  0 0 "[    .    1    .    2]" 1 
       1817 1  85 LYS HE2  1  90 HIS HA   . . 5.440 5.298 5.141 5.435     .  0 0 "[    .    1    .    2]" 1 
       1818 1  85 LYS HE2  1  90 HIS HD2  . . 4.370 3.883 3.613 4.307     .  0 0 "[    .    1    .    2]" 1 
       1819 1  85 LYS HE3  1  85 LYS HG3  . . 4.160 3.505 3.442 3.642     .  0 0 "[    .    1    .    2]" 1 
       1820 1  85 LYS HE3  1  86 TRP H    . . 5.350 4.639 4.280 5.058     .  0 0 "[    .    1    .    2]" 1 
       1821 1  85 LYS HE3  1  88 GLU HA   . . 4.460 3.888 3.623 4.107     .  0 0 "[    .    1    .    2]" 1 
       1822 1  85 LYS HE3  1  89 GLU H    . . 5.030 3.290 2.923 3.842     .  0 0 "[    .    1    .    2]" 1 
       1823 1  85 LYS HE3  1  89 GLU HA   . . 4.900 3.803 3.430 4.324     .  0 0 "[    .    1    .    2]" 1 
       1824 1  85 LYS HE3  1  90 HIS H    . . 5.500 4.909 4.570 5.371     .  0 0 "[    .    1    .    2]" 1 
       1825 1  85 LYS HE3  1  90 HIS HA   . . 4.980 4.416 4.159 4.786     .  0 0 "[    .    1    .    2]" 1 
       1826 1  85 LYS HG2  1  86 TRP H    . . 4.460 3.778 3.671 3.916     .  0 0 "[    .    1    .    2]" 1 
       1827 1  85 LYS HG2  1  90 HIS H    . . 5.020 4.711 4.525 4.895     .  0 0 "[    .    1    .    2]" 1 
       1828 1  85 LYS HG2  1  90 HIS HA   . . 3.880 2.911 2.759 3.003     .  0 0 "[    .    1    .    2]" 1 
       1829 1  85 LYS HG2  1  91 ILE H    . . 4.780 4.710 4.577 4.776     .  0 0 "[    .    1    .    2]" 1 
       1830 1  85 LYS HG3  1  86 TRP H    . . 5.500 4.806 4.750 4.851     .  0 0 "[    .    1    .    2]" 1 
       1831 1  85 LYS HG3  1  90 HIS HA   . . 4.200 4.062 3.885 4.168     .  0 0 "[    .    1    .    2]" 1 
       1832 1  85 LYS HG3  1  90 HIS HE1  . . 4.160 3.562 3.315 3.836     .  0 0 "[    .    1    .    2]" 1 
       1833 1  86 TRP H    1  86 TRP HB2  . . 3.630 3.303 3.198 3.384     .  0 0 "[    .    1    .    2]" 1 
       1834 1  86 TRP H    1  86 TRP QB   . . 3.100 2.550 2.507 2.585     .  0 0 "[    .    1    .    2]" 1 
       1835 1  86 TRP H    1  86 TRP HB3  . . 3.630 2.654 2.612 2.726     .  0 0 "[    .    1    .    2]" 1 
       1836 1  86 TRP H    1  87 GLY H    . . 4.100 3.766 3.665 3.857     .  0 0 "[    .    1    .    2]" 1 
       1837 1  86 TRP H    1  89 GLU H    . . 3.170 2.739 2.628 2.821     .  0 0 "[    .    1    .    2]" 1 
       1838 1  86 TRP H    1  89 GLU HB2  . . 4.090 2.994 2.909 3.122     .  0 0 "[    .    1    .    2]" 1 
       1839 1  86 TRP H    1  89 GLU HB3  . . 4.260 3.994 3.846 4.126     .  0 0 "[    .    1    .    2]" 1 
       1840 1  86 TRP H    1  89 GLU HG3  . . 5.500 4.974 4.805 5.180     .  0 0 "[    .    1    .    2]" 1 
       1841 1  86 TRP H    1  90 HIS HA   . . 4.060 3.289 3.133 3.435     .  0 0 "[    .    1    .    2]" 1 
       1842 1  86 TRP H    1  91 ILE H    . . 4.380 3.724 3.480 3.872     .  0 0 "[    .    1    .    2]" 1 
       1843 1  86 TRP H    1  91 ILE MG   . . 3.890 3.700 3.574 3.844     .  0 0 "[    .    1    .    2]" 1 
       1844 1  86 TRP HA   1  86 TRP HE3  . . 3.710 2.370 2.112 2.697     .  0 0 "[    .    1    .    2]" 1 
       1845 1  86 TRP HA   1  87 GLY H    . . 2.930 2.245 2.204 2.298     .  0 0 "[    .    1    .    2]" 1 
       1846 1  86 TRP HA   1  87 GLY HA3  . . 4.710 4.315 4.303 4.325     .  0 0 "[    .    1    .    2]" 1 
       1847 1  86 TRP QB   1  86 TRP HE1  . . 4.530 4.391 4.378 4.409     .  0 0 "[    .    1    .    2]" 1 
       1848 1  86 TRP QB   1  89 GLU H    . . 5.150 4.504 4.383 4.612     .  0 0 "[    .    1    .    2]" 1 
       1849 1  86 TRP QB   1  91 ILE MG   . . 3.270 2.421 2.293 2.602     .  0 0 "[    .    1    .    2]" 1 
       1850 1  86 TRP HB2  1  91 ILE MG   . . 3.730 2.544 2.388 2.798     .  0 0 "[    .    1    .    2]" 1 
       1851 1  86 TRP HB3  1  91 ILE MG   . . 3.730 3.058 2.828 3.243     .  0 0 "[    .    1    .    2]" 1 
       1852 1  86 TRP HE3  1  87 GLY H    . . 4.210 3.881 3.640 4.199     .  0 0 "[    .    1    .    2]" 1 
       1853 1  87 GLY H    1  88 GLU H    . . 4.120 3.172 3.122 3.299     .  0 0 "[    .    1    .    2]" 1 
       1854 1  87 GLY HA2  1  88 GLU H    . . 2.960 2.438 2.378 2.478     .  0 0 "[    .    1    .    2]" 1 
       1855 1  87 GLY HA2  1  89 GLU H    . . 4.750 4.504 4.308 4.648     .  0 0 "[    .    1    .    2]" 1 
       1856 1  87 GLY HA3  1  89 GLU H    . . 4.950 4.744 4.499 4.898     .  0 0 "[    .    1    .    2]" 1 
       1857 1  88 GLU H    1  88 GLU HB2  . . 3.460 3.422 3.368 3.464 0.004 16 0 "[    .    1    .    2]" 1 
       1858 1  88 GLU H    1  88 GLU HG2  . . 3.630 3.399 3.163 3.615     .  0 0 "[    .    1    .    2]" 1 
       1859 1  88 GLU H    1  88 GLU QG   . . 3.110 2.939 2.772 3.031     .  0 0 "[    .    1    .    2]" 1 
       1860 1  88 GLU H    1  88 GLU HG3  . . 3.630 3.241 2.885 3.404     .  0 0 "[    .    1    .    2]" 1 
       1861 1  88 GLU H    1  89 GLU H    . . 3.210 2.755 2.682 2.839     .  0 0 "[    .    1    .    2]" 1 
       1862 1  88 GLU H    1  89 GLU HG3  . . 5.500 4.860 4.649 5.142     .  0 0 "[    .    1    .    2]" 1 
       1863 1  88 GLU HA   1  88 GLU HG2  . . 3.730 2.308 2.216 2.492     .  0 0 "[    .    1    .    2]" 1 
       1864 1  88 GLU HA   1  88 GLU QG   . . 3.140 2.254 2.178 2.376     .  0 0 "[    .    1    .    2]" 1 
       1865 1  88 GLU HA   1  88 GLU HG3  . . 3.730 3.187 2.996 3.342     .  0 0 "[    .    1    .    2]" 1 
       1866 1  88 GLU HB2  1  89 GLU H    . . 4.360 4.305 4.191 4.365 0.005 19 0 "[    .    1    .    2]" 1 
       1867 1  88 GLU HB2  1  89 GLU HG2  . . 4.720 4.597 4.401 4.713     .  0 0 "[    .    1    .    2]" 1 
       1868 1  88 GLU HB2  1  89 GLU HG3  . . 4.550 3.663 3.521 3.778     .  0 0 "[    .    1    .    2]" 1 
       1869 1  89 GLU H    1  89 GLU HB2  . . 3.180 2.934 2.854 2.981     .  0 0 "[    .    1    .    2]" 1 
       1870 1  89 GLU H    1  89 GLU HB3  . . 3.990 3.930 3.892 3.958     .  0 0 "[    .    1    .    2]" 1 
       1871 1  89 GLU H    1  89 GLU HG2  . . 4.240 4.101 4.005 4.189     .  0 0 "[    .    1    .    2]" 1 
       1872 1  89 GLU H    1  89 GLU HG3  . . 3.920 3.605 3.377 3.860     .  0 0 "[    .    1    .    2]" 1 
       1873 1  89 GLU HA   1  89 GLU HG2  . . 3.660 2.361 2.254 2.453     .  0 0 "[    .    1    .    2]" 1 
       1874 1  89 GLU HA   1  89 GLU HG3  . . 3.670 3.260 3.208 3.303     .  0 0 "[    .    1    .    2]" 1 
       1875 1  89 GLU HA   1  90 HIS H    . . 2.670 2.555 2.488 2.603     .  0 0 "[    .    1    .    2]" 1 
       1876 1  89 GLU HA   1  90 HIS HD2  . . 4.630 3.177 3.097 3.299     .  0 0 "[    .    1    .    2]" 1 
       1877 1  89 GLU HB2  1  90 HIS H    . . 3.640 3.395 3.257 3.552     .  0 0 "[    .    1    .    2]" 1 
       1878 1  89 GLU HB3  1  90 HIS H    . . 3.750 2.108 2.009 2.233     .  0 0 "[    .    1    .    2]" 1 
       1879 1  89 GLU HG2  1  90 HIS H    . . 4.140 3.938 3.797 4.045     .  0 0 "[    .    1    .    2]" 1 
       1880 1  89 GLU HG3  1  90 HIS H    . . 5.500 4.766 4.676 4.822     .  0 0 "[    .    1    .    2]" 1 
       1881 1  90 HIS H    1  90 HIS HB2  . . 2.930 2.566 2.510 2.611     .  0 0 "[    .    1    .    2]" 1 
       1882 1  90 HIS H    1  90 HIS HB3  . . 3.900 3.700 3.669 3.728     .  0 0 "[    .    1    .    2]" 1 
       1883 1  90 HIS H    1  90 HIS HD2  . . 3.610 3.452 3.379 3.573     .  0 0 "[    .    1    .    2]" 1 
       1884 1  90 HIS H    1  91 ILE H    . . 4.600 4.125 4.028 4.204     .  0 0 "[    .    1    .    2]" 1 
       1885 1  90 HIS H    1  91 ILE MG   . . 5.490 5.145 5.009 5.200     .  0 0 "[    .    1    .    2]" 1 
       1886 1  90 HIS HA   1  91 ILE H    . . 2.880 2.145 2.139 2.161     .  0 0 "[    .    1    .    2]" 1 
       1887 1  90 HIS HA   1  91 ILE HG12 . . 4.480 4.037 3.917 4.231     .  0 0 "[    .    1    .    2]" 1 
       1888 1  90 HIS HA   1  91 ILE MG   . . 3.730 3.667 3.592 3.719     .  0 0 "[    .    1    .    2]" 1 
       1889 1  90 HIS HA   1  94 SER HG   . . 4.760 4.509 4.291 4.725     .  0 0 "[    .    1    .    2]" 1 
       1890 1  90 HIS HB2  1  90 HIS HD2  . . 3.780 3.017 2.922 3.079     .  0 0 "[    .    1    .    2]" 1 
       1891 1  90 HIS HB2  1  91 ILE H    . . 4.490 4.481 4.444 4.518 0.028 13 0 "[    .    1    .    2]" 1 
       1892 1  90 HIS HB2  1  94 SER HB3  . . 5.300 5.251 5.103 5.300 0.000 15 0 "[    .    1    .    2]" 1 
       1893 1  90 HIS HB2  1  94 SER HG   . . 5.040 4.787 4.604 4.902     .  0 0 "[    .    1    .    2]" 1 
       1894 1  90 HIS HB3  1  91 ILE H    . . 3.950 3.644 3.551 3.766     .  0 0 "[    .    1    .    2]" 1 
       1895 1  90 HIS HB3  1  94 SER H    . . 4.730 4.494 4.424 4.629     .  0 0 "[    .    1    .    2]" 1 
       1896 1  90 HIS HB3  1  94 SER HB2  . . 5.290 5.121 4.961 5.184     .  0 0 "[    .    1    .    2]" 1 
       1897 1  90 HIS HB3  1  94 SER HB3  . . 4.290 3.508 3.370 3.557     .  0 0 "[    .    1    .    2]" 1 
       1898 1  90 HIS HB3  1  94 SER HG   . . 4.540 3.153 2.978 3.300     .  0 0 "[    .    1    .    2]" 1 
       1899 1  90 HIS HE1  1  94 SER HG   . . 4.190 4.105 3.946 4.193 0.003 13 0 "[    .    1    .    2]" 1 
       1900 1  90 HIS HE1  1  95 PRO HD3  . . 5.380 5.218 4.912 5.380     . 17 0 "[    .    1    .    2]" 1 
       1901 1  91 ILE H    1  91 ILE HB   . . 3.950 3.618 3.610 3.628     .  0 0 "[    .    1    .    2]" 1 
       1902 1  91 ILE H    1  91 ILE MD   . . 4.100 3.886 3.794 4.018     .  0 0 "[    .    1    .    2]" 1 
       1903 1  91 ILE H    1  91 ILE HG12 . . 3.410 2.401 2.311 2.577     .  0 0 "[    .    1    .    2]" 1 
       1904 1  91 ILE H    1  91 ILE HG13 . . 3.740 3.279 3.116 3.405     .  0 0 "[    .    1    .    2]" 1 
       1905 1  91 ILE H    1  91 ILE MG   . . 3.050 1.910 1.888 1.955     .  0 0 "[    .    1    .    2]" 1 
       1906 1  91 ILE H    1  94 SER H    . . 5.280 5.184 5.073 5.279     .  0 0 "[    .    1    .    2]" 1 
       1907 1  91 ILE H    1  94 SER HB2  . . 5.500 5.284 5.132 5.445     .  0 0 "[    .    1    .    2]" 1 
       1908 1  91 ILE H    1  94 SER HB3  . . 4.250 4.040 3.876 4.149     .  0 0 "[    .    1    .    2]" 1 
       1909 1  91 ILE H    1  94 SER HG   . . 5.230 4.936 4.739 5.089     .  0 0 "[    .    1    .    2]" 1 
       1910 1  91 ILE HA   1  91 ILE MG   . . 3.440 2.410 2.353 2.445     .  0 0 "[    .    1    .    2]" 1 
       1911 1  91 ILE HA   1  92 PRO HD2  . . 3.700 2.348 2.327 2.364     .  0 0 "[    .    1    .    2]" 1 
       1912 1  91 ILE HA   1  92 PRO HD3  . . 3.800 2.281 2.274 2.286     .  0 0 "[    .    1    .    2]" 1 
       1913 1  91 ILE HA   1  92 PRO HG2  . . 4.610 4.470 4.453 4.483     .  0 0 "[    .    1    .    2]" 1 
       1914 1  91 ILE HA   1  92 PRO HG3  . . 4.610 4.442 4.430 4.450     .  0 0 "[    .    1    .    2]" 1 
       1915 1  91 ILE HB   1  91 ILE MD   . . 3.660 2.337 2.213 2.387     .  0 0 "[    .    1    .    2]" 1 
       1916 1  91 ILE HB   1  92 PRO HD2  . . 3.950 2.027 1.998 2.076     .  0 0 "[    .    1    .    2]" 1 
       1917 1  91 ILE HB   1  92 PRO HD3  . . 3.740 3.471 3.443 3.515     .  0 0 "[    .    1    .    2]" 1 
       1918 1  91 ILE HB   1  94 SER H    . . 5.420 4.965 4.791 5.200     .  0 0 "[    .    1    .    2]" 1 
       1919 1  91 ILE HB   1  96 PHE QE   . . 5.110 4.265 4.064 4.652     .  0 0 "[    .    1    .    2]" 1 
       1920 1  91 ILE MD   1  94 SER H    . . 4.390 3.906 3.570 4.062     .  0 0 "[    .    1    .    2]" 1 
       1921 1  91 ILE MD   1  94 SER HB2  . . 4.320 3.142 2.910 3.716     .  0 0 "[    .    1    .    2]" 1 
       1922 1  91 ILE MD   1  94 SER HB3  . . 4.150 3.474 3.287 3.793     .  0 0 "[    .    1    .    2]" 1 
       1923 1  91 ILE MD   1  96 PHE QD   . . 4.270 3.185 2.882 3.651     .  0 0 "[    .    1    .    2]" 1 
       1924 1  91 ILE MD   1  96 PHE QE   . . 3.550 1.916 1.813 2.230     .  0 0 "[    .    1    .    2]" 1 
       1925 1  91 ILE MD   1  96 PHE HZ   . . 3.740 3.120 2.245 3.467     .  0 0 "[    .    1    .    2]" 1 
       1926 1  91 ILE HG12 1  91 ILE MG   . . 3.420 2.317 2.250 2.365     .  0 0 "[    .    1    .    2]" 1 
       1927 1  91 ILE HG12 1  94 SER H    . . 4.480 4.202 4.024 4.396     .  0 0 "[    .    1    .    2]" 1 
       1928 1  91 ILE HG12 1  94 SER HB2  . . 4.820 3.525 3.348 3.875     .  0 0 "[    .    1    .    2]" 1 
       1929 1  91 ILE HG12 1  94 SER HB3  . . 4.580 2.936 2.724 3.206     .  0 0 "[    .    1    .    2]" 1 
       1930 1  91 ILE HG13 1  91 ILE MG   . . 3.500 3.185 3.158 3.201     .  0 0 "[    .    1    .    2]" 1 
       1931 1  91 ILE HG13 1  92 PRO HD2  . . 4.010 3.999 3.936 4.012 0.002  8 0 "[    .    1    .    2]" 1 
       1932 1  91 ILE HG13 1  92 PRO HD3  . . 5.090 4.951 4.897 4.990     .  0 0 "[    .    1    .    2]" 1 
       1933 1  91 ILE HG13 1  94 SER H    . . 3.800 2.794 2.566 3.013     .  0 0 "[    .    1    .    2]" 1 
       1934 1  91 ILE HG13 1  94 SER HB2  . . 4.420 3.343 3.103 3.731     .  0 0 "[    .    1    .    2]" 1 
       1935 1  91 ILE HG13 1  94 SER HB3  . . 4.620 2.545 2.313 2.888     .  0 0 "[    .    1    .    2]" 1 
       1936 1  91 ILE HG13 1  96 PHE QD   . . 4.470 4.299 4.135 4.454     .  0 0 "[    .    1    .    2]" 1 
       1937 1  91 ILE HG13 1  96 PHE QE   . . 4.860 2.648 2.296 3.002     .  0 0 "[    .    1    .    2]" 1 
       1938 1  91 ILE HG13 1  96 PHE HZ   . . 4.980 4.433 3.885 4.899     .  0 0 "[    .    1    .    2]" 1 
       1939 1  91 ILE MG   1  92 PRO HD2  . . 4.240 3.172 3.110 3.218     .  0 0 "[    .    1    .    2]" 1 
       1940 1  91 ILE MG   1  92 PRO HD3  . . 4.060 3.942 3.875 4.007     .  0 0 "[    .    1    .    2]" 1 
       1941 1  92 PRO HA   1  93 GLY H    . . 2.630 2.254 2.198 2.290     .  0 0 "[    .    1    .    2]" 1 
       1942 1  92 PRO HA   1  93 GLY QA   . . 4.350 3.909 3.904 3.914     .  0 0 "[    .    1    .    2]" 1 
       1943 1  92 PRO HA   1  94 SER H    . . 3.970 3.823 3.710 3.932     .  0 0 "[    .    1    .    2]" 1 
       1944 1  92 PRO QB   1  93 GLY H    . . 3.800 3.748 3.647 3.801 0.001 20 0 "[    .    1    .    2]" 1 
       1945 1  92 PRO HB2  1  93 GLY H    . . 4.460 4.066 3.944 4.130     .  0 0 "[    .    1    .    2]" 1 
       1946 1  92 PRO HB3  1  93 GLY H    . . 4.460 4.392 4.296 4.443     .  0 0 "[    .    1    .    2]" 1 
       1947 1  93 GLY H    1  94 SER H    . . 3.120 1.968 1.847 2.226     .  0 0 "[    .    1    .    2]" 1 
       1948 1  93 GLY H    1  94 SER HA   . . 5.090 4.561 4.473 4.694     .  0 0 "[    .    1    .    2]" 1 
       1949 1  93 GLY H    1  94 SER HB2  . . 5.500 5.163 5.070 5.343     .  0 0 "[    .    1    .    2]" 1 
       1950 1  93 GLY H    1  94 SER HB3  . . 5.320 4.095 4.004 4.253     .  0 0 "[    .    1    .    2]" 1 
       1951 1  93 GLY H    1  96 PHE HZ   . . 5.410 4.995 4.627 5.331     .  0 0 "[    .    1    .    2]" 1 
       1952 1  93 GLY QA   1  96 PHE QE   . . 3.780 2.861 2.437 3.030     .  0 0 "[    .    1    .    2]" 1 
       1953 1  93 GLY QA   1  96 PHE HZ   . . 3.920 2.382 2.170 2.748     .  0 0 "[    .    1    .    2]" 1 
       1954 1  93 GLY HA2  1  96 PHE QE   . . 4.410 4.116 3.820 4.367     .  0 0 "[    .    1    .    2]" 1 
       1955 1  93 GLY HA2  1  96 PHE HZ   . . 4.560 4.075 3.803 4.486     .  0 0 "[    .    1    .    2]" 1 
       1956 1  93 GLY HA3  1  96 PHE QE   . . 4.410 2.920 2.466 3.090     .  0 0 "[    .    1    .    2]" 1 
       1957 1  93 GLY HA3  1  96 PHE HZ   . . 4.560 2.398 2.181 2.773     .  0 0 "[    .    1    .    2]" 1 
       1958 1  94 SER H    1  94 SER HB2  . . 3.230 3.204 3.108 3.246 0.016 17 0 "[    .    1    .    2]" 1 
       1959 1  94 SER H    1  94 SER HB3  . . 3.270 2.265 2.214 2.321     .  0 0 "[    .    1    .    2]" 1 
       1960 1  94 SER H    1  94 SER HG   . . 4.160 3.938 3.893 3.995     .  0 0 "[    .    1    .    2]" 1 
       1961 1  94 SER H    1  95 PRO HA   . . 4.910 4.773 4.763 4.783     .  0 0 "[    .    1    .    2]" 1 
       1962 1  94 SER H    1  96 PHE QD   . . 4.560 4.063 3.739 4.375     .  0 0 "[    .    1    .    2]" 1 
       1963 1  94 SER H    1  96 PHE QE   . . 4.210 3.243 2.652 3.754     .  0 0 "[    .    1    .    2]" 1 
       1964 1  94 SER H    1  96 PHE HZ   . . 5.030 4.622 4.085 4.963     .  0 0 "[    .    1    .    2]" 1 
       1965 1  94 SER HA   1  95 PRO HA   . . 3.440 2.352 2.322 2.369     .  0 0 "[    .    1    .    2]" 1 
       1966 1  94 SER HA   1  95 PRO HB2  . . 4.520 4.378 4.361 4.387     .  0 0 "[    .    1    .    2]" 1 
       1967 1  94 SER HA   1  95 PRO HB3  . . 4.520 4.463 4.439 4.477     .  0 0 "[    .    1    .    2]" 1 
       1968 1  94 SER HA   1  95 PRO HD3  . . 4.800 4.620 4.609 4.626     .  0 0 "[    .    1    .    2]" 1 
       1969 1  94 SER HA   1  96 PHE H    . . 3.520 2.450 2.284 2.722     .  0 0 "[    .    1    .    2]" 1 
       1970 1  94 SER HA   1  96 PHE HB2  . . 5.100 3.968 3.852 4.093     .  0 0 "[    .    1    .    2]" 1 
       1971 1  94 SER HA   1  96 PHE QD   . . 4.030 2.548 2.123 2.953     .  0 0 "[    .    1    .    2]" 1 
       1972 1  94 SER HA   1  96 PHE QE   . . 4.450 3.713 3.216 4.036     .  0 0 "[    .    1    .    2]" 1 
       1973 1  94 SER HB2  1  95 PRO HA   . . 5.000 2.872 2.817 2.974     .  0 0 "[    .    1    .    2]" 1 
       1974 1  94 SER HB2  1  96 PHE HB2  . . 4.560 4.291 4.156 4.432     .  0 0 "[    .    1    .    2]" 1 
       1975 1  94 SER HB2  1  96 PHE QD   . . 5.150 2.221 1.996 2.488     .  0 0 "[    .    1    .    2]" 1 
       1976 1  94 SER HB2  1  96 PHE QE   . . 4.820 3.088 2.496 3.553     .  0 0 "[    .    1    .    2]" 1 
       1977 1  94 SER HB3  1  95 PRO HA   . . 4.760 3.764 3.747 3.793     .  0 0 "[    .    1    .    2]" 1 
       1978 1  94 SER HB3  1  96 PHE QD   . . 4.550 3.707 3.522 3.961     .  0 0 "[    .    1    .    2]" 1 
       1979 1  94 SER HB3  1  96 PHE QE   . . 4.300 3.561 2.901 4.019     .  0 0 "[    .    1    .    2]" 1 
       1980 1  94 SER HG   1  95 PRO HA   . . 4.310 3.055 3.012 3.114     .  0 0 "[    .    1    .    2]" 1 
       1981 1  95 PRO HA   1  96 PHE H    . . 2.980 2.165 2.152 2.202     .  0 0 "[    .    1    .    2]" 1 
       1982 1  95 PRO HA   1  96 PHE HA   . . 4.870 4.377 4.369 4.387     .  0 0 "[    .    1    .    2]" 1 
       1983 1  95 PRO HA   1  96 PHE HB2  . . 4.810 4.370 4.313 4.457     .  0 0 "[    .    1    .    2]" 1 
       1984 1  95 PRO HA   1  96 PHE QD   . . 4.320 3.707 3.250 4.052     .  0 0 "[    .    1    .    2]" 1 
       1985 1  95 PRO QB   1  96 PHE H    . . 3.680 3.237 3.059 3.336     .  0 0 "[    .    1    .    2]" 1 
       1986 1  95 PRO HB2  1  96 PHE H    . . 4.190 3.442 3.225 3.563     .  0 0 "[    .    1    .    2]" 1 
       1987 1  95 PRO HB3  1  96 PHE H    . . 4.190 3.940 3.801 4.020     .  0 0 "[    .    1    .    2]" 1 
       1988 1  96 PHE H    1  96 PHE HB2  . . 3.510 2.250 2.199 2.331     .  0 0 "[    .    1    .    2]" 1 
       1989 1  96 PHE H    1  96 PHE HB3  . . 3.870 3.536 3.499 3.586     .  0 0 "[    .    1    .    2]" 1 
       1990 1  96 PHE H    1  96 PHE QD   . . 3.250 2.511 2.237 2.813     .  0 0 "[    .    1    .    2]" 1 
       1991 1  96 PHE H    1  96 PHE QE   . . 5.070 4.729 4.526 4.942     .  0 0 "[    .    1    .    2]" 1 
       1992 1  96 PHE H    1  97 HIS H    . . 4.740 4.604 4.556 4.628     .  0 0 "[    .    1    .    2]" 1 
       1993 1  96 PHE HA   1  96 PHE QD   . . 3.800 3.005 2.875 3.107     .  0 0 "[    .    1    .    2]" 1 
       1994 1  96 PHE HA   1  97 HIS H    . . 2.700 2.296 2.178 2.413     .  0 0 "[    .    1    .    2]" 1 
       1995 1  96 PHE HA   1  97 HIS HB2  . . 4.740 4.477 4.373 4.554     .  0 0 "[    .    1    .    2]" 1 
       1996 1  96 PHE HA   1  97 HIS HB3  . . 4.740 4.583 4.495 4.708     .  0 0 "[    .    1    .    2]" 1 
       1997 1  96 PHE HB2  1  97 HIS H    . . 4.320 4.023 3.826 4.278     .  0 0 "[    .    1    .    2]" 1 
       1998 1  96 PHE HB2  1  98 VAL MG2  . . 3.960 3.542 3.373 3.710     .  0 0 "[    .    1    .    2]" 1 
       1999 1  96 PHE HB3  1  97 HIS H    . . 3.270 2.761 2.449 3.182     .  0 0 "[    .    1    .    2]" 1 
       2000 1  96 PHE HB3  1  98 VAL MG2  . . 4.050 3.076 2.878 3.220     .  0 0 "[    .    1    .    2]" 1 
       2001 1  96 PHE QD   1  97 HIS H    . . 3.930 3.439 3.126 3.907     .  0 0 "[    .    1    .    2]" 1 
       2002 1  96 PHE QD   1  98 VAL MG2  . . 4.600 4.412 4.175 4.596     .  0 0 "[    .    1    .    2]" 1 
       2003 1  97 HIS H    1  97 HIS HB2  . . 3.550 2.937 2.812 3.082     .  0 0 "[    .    1    .    2]" 1 
       2004 1  97 HIS H    1  97 HIS QB   . . 2.950 2.356 2.308 2.442     .  0 0 "[    .    1    .    2]" 1 
       2005 1  97 HIS H    1  97 HIS HB3  . . 3.550 2.483 2.420 2.580     .  0 0 "[    .    1    .    2]" 1 
       2006 1  97 HIS H    1  97 HIS HD2  . . 5.230 5.113 5.010 5.198     .  0 0 "[    .    1    .    2]" 1 
       2007 1  97 HIS H    1  98 VAL H    . . 4.530 4.168 4.077 4.395     .  0 0 "[    .    1    .    2]" 1 
       2008 1  97 HIS H    1  98 VAL MG2  . . 4.330 4.157 3.874 4.328     .  0 0 "[    .    1    .    2]" 1 
       2009 1  97 HIS HA   1  97 HIS HD2  . . 4.190 2.548 2.399 2.677     .  0 0 "[    .    1    .    2]" 1 
       2010 1  97 HIS HA   1  98 VAL H    . . 2.750 2.180 2.140 2.205     .  0 0 "[    .    1    .    2]" 1 
       2011 1  97 HIS HA   1  98 VAL HA   . . 4.890 4.418 4.395 4.442     .  0 0 "[    .    1    .    2]" 1 
       2012 1  97 HIS HA   1  98 VAL HB   . . 4.730 4.656 4.549 4.731 0.001  3 0 "[    .    1    .    2]" 1 
       2013 1  97 HIS HB2  1  98 VAL H    . . 4.600 4.442 4.299 4.497     .  0 0 "[    .    1    .    2]" 1 
       2014 1  97 HIS HB3  1  98 VAL H    . . 4.600 4.448 4.305 4.506     .  0 0 "[    .    1    .    2]" 1 
       2015 1  97 HIS HD2  1  98 VAL H    . . 4.380 3.159 2.883 3.508     .  0 0 "[    .    1    .    2]" 1 
       2016 1  98 VAL H    1  98 VAL HB   . . 3.170 2.510 2.387 2.594     .  0 0 "[    .    1    .    2]" 1 
       2017 1  98 VAL H    1  98 VAL MG1  . . 4.130 3.790 3.732 3.822     .  0 0 "[    .    1    .    2]" 1 
       2018 1  98 VAL H    1  98 VAL MG2  . . 3.400 2.645 2.461 2.856     .  0 0 "[    .    1    .    2]" 1 
       2019 1  98 VAL H    1  99 THR H    . . 4.830 4.347 4.233 4.468     .  0 0 "[    .    1    .    2]" 1 
       2020 1  98 VAL HA   1  98 VAL MG1  . . 3.280 2.436 2.325 2.497     .  0 0 "[    .    1    .    2]" 1 
       2021 1  98 VAL HA   1  98 VAL MG2  . . 3.240 2.322 2.231 2.429     .  0 0 "[    .    1    .    2]" 1 
       2022 1  98 VAL HA   1  99 THR H    . . 2.720 2.146 2.139 2.165     .  0 0 "[    .    1    .    2]" 1 
       2023 1  98 VAL HA   1  99 THR HB   . . 4.660 4.644 4.605 4.661 0.001  1 0 "[    .    1    .    2]" 1 
       2024 1  98 VAL HB   1  99 THR H    . . 4.640 4.315 4.150 4.424     .  0 0 "[    .    1    .    2]" 1 
       2025 1  98 VAL HB   1 100 VAL MG2  . . 4.430 4.326 4.113 4.431 0.001 18 0 "[    .    1    .    2]" 1 
       2026 1  98 VAL MG1  1  99 THR H    . . 3.270 2.725 2.405 3.132     .  0 0 "[    .    1    .    2]" 1 
       2027 1  98 VAL MG1  1  99 THR HB   . . 4.950 4.646 4.451 4.834     .  0 0 "[    .    1    .    2]" 1 
       2028 1  98 VAL MG1  1 100 VAL H    . . 4.810 4.258 4.034 4.755     .  0 0 "[    .    1    .    2]" 1 
       2029 1  98 VAL MG1  1 100 VAL MG2  . . 3.110 2.584 2.319 2.868     .  0 0 "[    .    1    .    2]" 1 
       2030 1  98 VAL MG2  1  99 THR H    . . 4.120 4.039 3.896 4.120 0.000 18 0 "[    .    1    .    2]" 1 
       2031 1  99 THR H    1  99 THR HB   . . 3.130 2.561 2.507 2.639     .  0 0 "[    .    1    .    2]" 1 
       2032 1  99 THR H    1  99 THR MG   . . 3.980 3.821 3.791 3.856     .  0 0 "[    .    1    .    2]" 1 
       2033 1  99 THR H    1 100 VAL H    . . 4.840 4.458 4.380 4.568     .  0 0 "[    .    1    .    2]" 1 
       2034 1  99 THR HA   1  99 THR MG   . . 3.120 2.368 2.293 2.460     .  0 0 "[    .    1    .    2]" 1 
       2035 1  99 THR HA   1 100 VAL H    . . 2.990 2.171 2.146 2.277     .  0 0 "[    .    1    .    2]" 1 
       2036 1  99 THR HB   1 100 VAL H    . . 4.210 4.125 3.846 4.209     .  0 0 "[    .    1    .    2]" 1 
       2037 1  99 THR MG   1 100 VAL H    . . 3.590 2.389 1.985 2.691     .  0 0 "[    .    1    .    2]" 1 
       2038 1  99 THR MG   1 101 PRO HA   . . 4.390 4.035 3.869 4.200     .  0 0 "[    .    1    .    2]" 1 
       2039 1 100 VAL H    1 100 VAL HB   . . 3.280 2.608 2.516 2.749     .  0 0 "[    .    1    .    2]" 1 
       2040 1 100 VAL H    1 100 VAL MG1  . . 4.190 3.832 3.788 3.895     .  0 0 "[    .    1    .    2]" 1 
       2041 1 100 VAL H    1 100 VAL MG2  . . 3.460 2.720 2.347 2.994     .  0 0 "[    .    1    .    2]" 1 
       2042 1 100 VAL H    1 101 PRO HD2  . . 5.470 4.798 4.728 4.840     .  0 0 "[    .    1    .    2]" 1 
       2043 1 100 VAL H    1 101 PRO QD   . . 4.730 4.209 4.074 4.313     .  0 0 "[    .    1    .    2]" 1 
       2044 1 100 VAL H    1 101 PRO HD3  . . 5.470 4.660 4.447 4.843     .  0 0 "[    .    1    .    2]" 1 
       2045 1 100 VAL HA   1 100 VAL MG1  . . 3.460 2.387 2.204 2.495     .  0 0 "[    .    1    .    2]" 1 
       2046 1 100 VAL HA   1 100 VAL MG2  . . 3.430 2.359 2.215 2.492     .  0 0 "[    .    1    .    2]" 1 
       2047 1 100 VAL HA   1 101 PRO HD2  . . 3.340 2.048 1.967 2.163     .  0 0 "[    .    1    .    2]" 1 
       2048 1 100 VAL HA   1 101 PRO HD3  . . 3.340 2.284 2.252 2.335     .  0 0 "[    .    1    .    2]" 1 
       2049 1 100 VAL HA   1 101 PRO HG2  . . 4.460 4.232 4.167 4.322     .  0 0 "[    .    1    .    2]" 1 
       2050 1 100 VAL HA   1 101 PRO QG   . . 3.880 3.809 3.776 3.864     .  0 0 "[    .    1    .    2]" 1 
       2051 1 100 VAL HA   1 101 PRO HG3  . . 4.460 4.324 4.315 4.353     .  0 0 "[    .    1    .    2]" 1 
       2052 1 100 VAL MG1  1 101 PRO HD2  . . 3.950 2.010 1.812 2.480     .  0 0 "[    .    1    .    2]" 1 
       2053 1 100 VAL MG1  1 101 PRO QD   . . 3.420 1.995 1.802 2.445     .  0 0 "[    .    1    .    2]" 1 
       2054 1 100 VAL MG1  1 101 PRO HD3  . . 3.950 3.391 3.152 3.703     .  0 0 "[    .    1    .    2]" 1 
       2055 1 100 VAL MG2  1 101 PRO HD2  . . 4.490 3.510 3.322 3.726     .  0 0 "[    .    1    .    2]" 1 
       2056 1 100 VAL MG2  1 101 PRO QD   . . 3.890 3.346 3.179 3.534     .  0 0 "[    .    1    .    2]" 1 
       2057 1 100 VAL MG2  1 101 PRO HD3  . . 4.490 4.218 4.054 4.388     .  0 0 "[    .    1    .    2]" 1 
    stop_

save_



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